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 10 results

Search term: ILQHKCVUXDKCEO (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
2385987

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C25H35NO3/c1-5-24(2)19-25(15-17-29-24,22-8-6-7-9-23(22)28-4)14-16-26-18-20-10-12-21(27-3)13-11-20/h6-13,26H,5,14-19H2,1-4H3
C25H35NO3397.550315700
17462197

1 of 2 defined stereocentres - 1/2 defined
InChI=1/C25H35NO3/c1-5-24(2)19-25(15-17-29-24,22-8-6-7-9-23(22)28-4)14-16-26-18-20-10-12-21(27-3)13-11-20/h6-13,26H,5,14-19H2,1-4H3/t24?,25-/m1/s1
C25H35NO3397.550312800
5751253

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C25H35NO3/c1-5-24(2)19-25(15-17-29-24,22-8-6-7-9-23(22)28-4)14-16-26-18-20-10-12-21(27-3)13-11-20/h6-13,26H,5,14-19H2,1-4H3/t24-,25-/m0/s1
C25H35NO3397.55032100
5429947

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C25H35NO3/c1-5-24(2)19-25(15-17-29-24,22-8-6-7-9-23(22)28-4)14-16-26-18-20-10-12-21(27-3)13-11-20/h6-13,26H,5,14-19H2,1-4H3/t24-,25-/m1/s1
C25H35NO3397.55032100
5429949

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C25H35NO3/c1-5-24(2)19-25(15-17-29-24,22-8-6-7-9-23(22)28-4)14-16-26-18-20-10-12-21(27-3)13-11-20/h6-13,26H,5,14-19H2,1-4H3/t24-,25+/m0/s1
C25H35NO3397.55032100
5751250

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C25H35NO3/c1-5-24(2)19-25(15-17-29-24,22-8-6-7-9-23(22)28-4)14-16-26-18-20-10-12-21(27-3)13-11-20/h6-13,26H,5,14-19H2,1-4H3/t24-,25+/m1/s1
C25H35NO3397.55032100
5751252

Charge

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C25H35NO3/c1-5-24(2)19-25(15-17-29-24,22-8-6-7-9-23(22)28-4)14-16-26-18-20-10-12-21(27-3)13-11-20/h6-13,26H,5,14-19H2,1-4H3/p+1/t24-,25-/m0/s1
C25H36NO3398.55771100
5751249

Charge

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C25H35NO3/c1-5-24(2)19-25(15-17-29-24,22-8-6-7-9-23(22)28-4)14-16-26-18-20-10-12-21(27-3)13-11-20/h6-13,26H,5,14-19H2,1-4H3/p+1/t24-,25+/m1/s1
C25H36NO3398.55771100
5429948

Charge

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C25H35NO3/c1-5-24(2)19-25(15-17-29-24,22-8-6-7-9-23(22)28-4)14-16-26-18-20-10-12-21(27-3)13-11-20/h6-13,26H,5,14-19H2,1-4H3/p+1/t24-,25+/m0/s1
C25H36NO3398.55771100
5429946

Charge

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C25H35NO3/c1-5-24(2)19-25(15-17-29-24,22-8-6-7-9-23(22)28-4)14-16-26-18-20-10-12-21(27-3)13-11-20/h6-13,26H,5,14-19H2,1-4H3/p+1/t24-,25-/m1/s1
C25H36NO3398.55771100

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