Matches any text strings used to describe a molecule.
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
Search Hits Limit:
Single/Multi-component
Isotopically Labeled
Additional Filters

Found 11 results

Search term: SSPWSCFMVXPMNL (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
4579488

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C22H21Cl2NO2/c1-25-8-7-22(15-3-2-4-16(26)11-15)12-20(25)17(21(27)13-22)9-14-5-6-18(23)19(24)10-14/h2-6,9-11,20,26H,7-8,12-13H2,1H3/b17-9+/t20-,22-/m1/s1
C22H21Cl2NO2402.313612600
4869043

Double-bond stereo

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C22H21Cl2NO2/c1-25-8-7-22(15-3-2-4-16(26)11-15)12-20(25)17(21(27)13-22)9-14-5-6-18(23)19(24)10-14/h2-6,9-11,20,26H,7-8,12-13H2,1H3/b17-9+
C22H21Cl2NO2402.31365500
13098461

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C22H21Cl2NO2/c1-25-8-7-22(15-3-2-4-16(26)11-15)12-20(25)17(21(27)13-22)9-14-5-6-18(23)19(24)10-14/h2-6,9-11,20,26H,7-8,12-13H2,1H3/b17-9+/t20-,22+/m0/s1
C22H21Cl2NO2402.31365400
4579490

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C22H21Cl2NO2/c1-25-8-7-22(15-3-2-4-16(26)11-15)12-20(25)17(21(27)13-22)9-14-5-6-18(23)19(24)10-14/h2-6,9-11,20,26H,7-8,12-13H2,1H3/b17-9+/t20-,22-/m0/s1
C22H21Cl2NO2402.31364300
342415

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C22H21Cl2NO2/c1-25-8-7-22(15-3-2-4-16(26)11-15)12-20(25)17(21(27)13-22)9-14-5-6-18(23)19(24)10-14/h2-6,9-11,20,26H,7-8,12-13H2,1H3/t20-,22-/m0/s1
C22H21Cl2NO2402.31363200
28501593

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C22H21Cl2NO2/c1-25-8-7-22(15-3-2-4-16(26)11-15)12-20(25)17(21(27)13-22)9-14-5-6-18(23)19(24)10-14/h2-6,9-11,20,26H,7-8,12-13H2,1H3/b17-9+/t20-,22+/m1/s1
C22H21Cl2NO2402.31363300
4286099

Double-bond stereo

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C22H21Cl2NO2/c1-25-8-7-22(15-3-2-4-16(26)11-15)12-20(25)17(21(27)13-22)9-14-5-6-18(23)19(24)10-14/h2-6,9-11,20,26H,7-8,12-13H2,1H3
C22H21Cl2NO2402.313642100
342414

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C22H21Cl2NO2/c1-25-8-7-22(15-3-2-4-16(26)11-15)12-20(25)17(21(27)13-22)9-14-5-6-18(23)19(24)10-14/h2-6,9-11,20,26H,7-8,12-13H2,1H3/t20-,22-/m1/s1
C22H21Cl2NO2402.31362100
34945782

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C22H21Cl2NO2/c1-25-8-7-22(15-3-2-4-16(26)11-15)12-20(25)17(21(27)13-22)9-14-5-6-18(23)19(24)10-14/h2-6,9-11,20,26H,7-8,12-13H2,1H3/t20-,22+/m1/s1
C22H21Cl2NO2402.31361100
123962047

Double-bond stereo

1 of 2 defined stereocentres - 1/2 defined
InChI=1/C22H21Cl2NO2/c1-25-8-7-22(15-3-2-4-16(26)11-15)12-20(25)17(21(27)13-22)9-14-5-6-18(23)19(24)10-14/h2-6,9-11,20,26H,7-8,12-13H2,1H3/b17-9+/t20?,22-/m1/s1
C22H21Cl2NO2402.31361100
24809194

Double-bond stereo

1 of 2 defined stereocentres - 1/2 defined
InChI=1/C22H21Cl2NO2/c1-25-8-7-22(15-3-2-4-16(26)11-15)12-20(25)17(21(27)13-22)9-14-5-6-18(23)19(24)10-14/h2-6,9-11,20,26H,7-8,12-13H2,1H3/t20?,22-/m1/s1
C22H21Cl2NO2402.31361100

Advertisement