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 8 results

Search term: WDSCDQQQRGGVPJ (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
9568046

Double-bond stereo

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C19H33NO3/c1-13(7-8-14(2)18(22)15(3)21)10-16-11-19(4,23)17-6-5-9-20(17)12-16/h8,10,13,15,17-18,21-23H,5-7,9,11-12H2,1-4H3/b14-8+,16-10-/t13-,15-,17+,18-,19+/m1/s1
C19H33NO3323.47027500
4941919

Double-bond stereo

4 of 5 defined stereocentres - 4/5 defined
InChI=1/C19H33NO3/c1-13(7-8-14(2)18(22)15(3)21)10-16-11-19(4,23)17-6-5-9-20(17)12-16/h8,10,13,15,17-18,21-23H,5-7,9,11-12H2,1-4H3/b14-8+,16-10-/t13?,15-,17+,18-,19+/m1/s1
C19H33NO3323.47024400
4518095

Double-bond stereo

0 of 5 defined stereocentres - 0/5 defined
InChI=1/C19H33NO3/c1-13(7-8-14(2)18(22)15(3)21)10-16-11-19(4,23)17-6-5-9-20(17)12-16/h8,10,13,15,17-18,21-23H,5-7,9,11-12H2,1-4H3/b14-8+,16-10-
C19H33NO3323.47023600
9898438

Double-bond stereo

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C19H33NO3/c1-13(7-8-14(2)18(22)15(3)21)10-16-11-19(4,23)17-6-5-9-20(17)12-16/h8,10,13,15,17-18,21-23H,5-7,9,11-12H2,1-4H3/b14-8+,16-10+/t13-,15+,17-,18+,19-/m0/s1
C19H33NO3323.47022100
10310884

Double-bond stereo

4 of 5 defined stereocentres - 4/5 defined
InChI=1/C19H33NO3/c1-13(7-8-14(2)18(22)15(3)21)10-16-11-19(4,23)17-6-5-9-20(17)12-16/h8,10,13,15,17-18,21-23H,5-7,9,11-12H2,1-4H3/b14-8+,16-10-/t13-,15-,17?,18-,19-/m0/s1
C19H33NO3323.47022200
23218741

Double-bond stereo

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C19H33NO3/c1-13(7-8-14(2)18(22)15(3)21)10-16-11-19(4,23)17-6-5-9-20(17)12-16/h8,10,13,15,17-18,21-23H,5-7,9,11-12H2,1-4H3/b14-8+,16-10-/t13-,15+,17-,18+,19-/m0/s1
C19H33NO3323.47022200
23218804

Double-bond stereo

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C19H33NO3/c1-13(7-8-14(2)18(22)15(3)21)10-16-11-19(4,23)17-6-5-9-20(17)12-16/h8,10,13,15,17-18,21-23H,5-7,9,11-12H2,1-4H3/b14-8+,16-10-/t13-,15+,17+,18+,19+/m1/s1
C19H33NO3323.47022200
23219003

Double-bond stereo

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C19H33NO3/c1-13(7-8-14(2)18(22)15(3)21)10-16-11-19(4,23)17-6-5-9-20(17)12-16/h8,10,13,15,17-18,21-23H,5-7,9,11-12H2,1-4H3/b14-8+,16-10-/t13-,15+,17+,18-,19+/m1/s1
C19H33NO3323.47022200

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