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 5 results

Search term: XFFHRRFIWWOTIR (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
2139776

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C29H32ClNO6/c1-5-36-13-14-37-29(33)25-17(2)31-22-15-19(18-9-11-20(30)12-10-18)16-23(32)27(22)26(25)21-7-6-8-24(34-3)28(21)35-4/h6-12,19,26,31H,5,13-16H2,1-4H3
C29H32ClNO6526.020479999999241600
62317779

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C29H32ClNO6/c1-5-36-13-14-37-29(33)25-17(2)31-22-15-19(18-9-11-20(30)12-10-18)16-23(32)27(22)26(25)21-7-6-8-24(34-3)28(21)35-4/h6-12,19,26,31H,5,13-16H2,1-4H3/t19-,26-/m1/s1
C29H32ClNO6526.02052200
62466680

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C29H32ClNO6/c1-5-36-13-14-37-29(33)25-17(2)31-22-15-19(18-9-11-20(30)12-10-18)16-23(32)27(22)26(25)21-7-6-8-24(34-3)28(21)35-4/h6-12,19,26,31H,5,13-16H2,1-4H3/t19-,26-/m0/s1
C29H32ClNO6526.02052300
62328973

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C29H32ClNO6/c1-5-36-13-14-37-29(33)25-17(2)31-22-15-19(18-9-11-20(30)12-10-18)16-23(32)27(22)26(25)21-7-6-8-24(34-3)28(21)35-4/h6-12,19,26,31H,5,13-16H2,1-4H3/t19-,26+/m0/s1
C29H32ClNO6526.02051200
62328974

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C29H32ClNO6/c1-5-36-13-14-37-29(33)25-17(2)31-22-15-19(18-9-11-20(30)12-10-18)16-23(32)27(22)26(25)21-7-6-8-24(34-3)28(21)35-4/h6-12,19,26,31H,5,13-16H2,1-4H3/t19-,26+/m1/s1
C29H32ClNO6526.02051100

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