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Systematic Name, Synonym, Trade Name, Registry Number, SMILES, InChI or CSID

Systematic names 1,2-dihydroxybenzene
Synonyms AIBN
Trade names Aspirin
Registry numbers 7732-18-5
SMILES O=C(OCC)C
InChl InChI=1/CH4/h1H4
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Found 900 results

Search term: C22H33NO4 (Found by molecular formula)
12345
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
91061

10 of 10 defined stereocentres - 10/10 defined
InChI=1/C22H33NO4/c1-4-13-14-7-5-6-8-23-16(17-9-11(2)21(24)26-17)10-15(19(14)23)18-12(3)22(25)27-20(13)18/h11-20H,4-10H2,1-3H3/t11-,12-,13+,14+,15+,16-,17-,18+,19+,20-/m0/s1
C22H33NO4375.5017584900
9842672

10 of 10 defined stereocentres - 10/10 defined
InChI=1/C22H33NO4/c1-4-13-14-7-5-6-8-23-16(17-9-11(2)21(24)26-17)10-15(19(14)23)18-12(3)22(25)27-20(13)18/h11-20H,4-10H2,1-3H3/t11-,12-,13+,14+,15-,16-,17-,18-,19+,20+/m0/s1
C22H33NO4375.5017363100
2205770

0 of 4 defined stereocentres - 0/4 defined
InChI=1/C22H33NO4/c1-5-25-19-12-17(13-20(26-6-2)21(19)27-7-3)22(24)23-14(4)18-11-15-8-9-16(18)10-15/h12-16,18H,5-11H2,1-4H3,(H,23,24)
C22H33NO4375.50172211400
997937
InChI=1/C22H33NO4/c1-25-19-14-16(15-20(26-2)21(19)27-3)22(24)23(17-10-6-4-7-11-17)18-12-8-5-9-13-18/h14-15,17-18H,4-13H2,1-3H3
C22H33NO4375.5017181100
2953584

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C22H33NO4/c1-16(2)22(9-11-27-21(4,5)14-22)8-10-23(17(3)24)13-18-6-7-19-20(12-18)26-15-25-19/h6-7,12,16H,8-11,13-15H2,1-5H3
C22H33NO4375.50172161200
384919

0 of 10 defined stereocentres - 0/10 defined
InChI=1/C22H33NO4/c1-4-13-14-7-5-6-8-23-16(17-9-11(2)21(24)26-17)10-15(19(14)23)18-12(3)22(25)27-20(13)18/h11-20H,4-10H2,1-3H3
C22H33NO4375.5017143200
515048

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C22H33NO4/c1-3-4-14-26-20-11-10-17(15-21(20)25-2)22(24)27-16-18-8-7-13-23-12-6-5-9-19(18)23/h10-11,15,18-19H,3-9,12-14,16H2,1-2H3
C22H33NO4375.501714700
571036

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C19H27NO.C3H6O3/c1-13(2)7-9-20-10-8-19(4)14(3)18(20)11-15-5-6-16(21)12-17(15)19;1-2(4)3(5)6/h5-7,12,14,18,21H,8-11H2,1-4H3;2,4H,1H3,(H,5,6)/t14-,18+,19+;/m0./s1
C22H33NO4375.50172121320
950499
InChI=1/C22H33NO4/c1-14-19(21(24)26-17-10-6-4-7-11-17)15(2)23-16(3)20(14)22(25)27-18-12-8-5-9-13-18/h14,17-18,23H,4-13H2,1-3H3
C22H33NO4375.501712600
4059898
InChI=1/C22H33NO4/c1-8-11-23-18(24)14-27-19(25)10-9-15-12-16(21(2,3)4)20(26)17(13-15)22(5,6)7/h8,12-13,26H,1,9-11,14H2,2-7H3,(H,23,24)
C22H33NO4375.5017212900
10050761

Double-bond stereo

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C22H33NO4/c1-20-9-6-15(23-27-13-19(24)25)12-14(20)4-5-16-17(20)7-10-21(2)18(16)8-11-22(21,3)26/h12,16-18,26H,4-11,13H2,1-3H3,(H,24,25)/t16-,17+,18+,20+,21+,22+/m1/s1
C22H33NO4375.501711700
17462331

3 of 4 defined stereocentres - 3/4 defined
InChI=1/C22H33NO4/c1-15-4-3-5-21(2)13-19-16(12-18(15)21)17(20(24)27-19)14-23-8-6-22(7-9-23)25-10-11-26-22/h16-17,19H,3-14H2,1-2H3/t16-,17?,19-,21-/m1/s1
C22H33NO4375.501711900
17462388

4 of 5 defined stereocentres - 4/5 defined
InChI=1/C22H33NO4/c1-15-4-3-5-21(2)13-19-16(12-18(15)21)17(20(24)27-19)14-23-8-6-22(7-9-23)25-10-11-26-22/h12,15-17,19H,3-11,13-14H2,1-2H3/t15-,16+,17?,19+,21+/m0/s1
C22H33NO4375.501711800
17463469

3 of 5 defined stereocentres - 3/5 defined
InChI=1/C22H33NO4/c1-15-4-3-5-21(2)13-19-16(12-18(15)21)17(20(24)27-19)14-23-8-6-22(7-9-23)25-10-11-26-22/h16-19H,1,3-14H2,2H3/t16-,17?,18?,19-,21-/m1/s1
C22H33NO4375.501710800
10892670

0 of 3 defined stereocentres - 0/3 defined
InChI=1/C22H33NO4/c1-22(2)17-9-8-16(19(22)12-17)14-26-15-18(24)13-23-10-11-27-21-7-5-4-6-20(21)25-3/h4-8,17-19,23-24H,9-15H2,1-3H3
C22H33NO4375.501710700
22875034

11 of 12 defined stereocentres - 11/12 defined
InChI=1/C22H33NO4/c1-4-23(27)10-20(3)6-5-17(25)22-15(20)7-13(18(22)23)21-9-12(11(2)19(21)26)14(24)8-16(21)22/h12-19,24-26H,2,4-10H2,1,3H3/t12-,13-,14-,15+,16+,17-,18?,19+,20-,21-,22-,23-/m0/s1
C22H33NO4375.50179600
28420717
InChI=1/C12H23N.C10H10O4/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12;1-7(11)14-9(10(12)13)8-5-3-2-4-6-8/h11-13H,1-10H2;2-6,9H,1H3,(H,12,13)
C22H33NO4375.50179400
17316793

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C22H33NO4/c1-26-21-15-18(7-8-20(21)25)5-4-11-23-12-9-22(17-24,10-13-23)16-19-6-2-3-14-27-19/h4-5,7-8,15,19,24-25H,2-3,6,9-14,16-17H2,1H3/b5-4+
C22H33NO4375.50178800
4977302

Double-bond stereo

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C22H33NO4/c1-15-7-5-9-17(21(24)25)10-6-8-16(2)13-20-18(12-11-15)19(14-23(3)4)22(26)27-20/h7,10,13,18-20H,5-6,8-9,11-12,14H2,1-4H3,(H,24,25)/b15-7+,16-13+,17-10-/t18-,19-,20-/m0/s1
C22H33NO4375.50178700
5478015

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C22H33NO4/c1-15-13-21(27-12-11-25-4)17(3)20-14-18(5-6-19(15)20)16(2)22(24)23-7-9-26-10-8-23/h13,16,18H,5-12,14H2,1-4H3/t16-,18+/m0/s1
C22H33NO4375.50178500
12345

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