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 3 results

Search term: QCXCLTCQYLFXKW (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
22947527

Double-bond stereo

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C30H37NO3/c1-4-6-18-33-24-12-8-22(9-13-24)20-26-28-16-17-29(31(28)3)27(30(26)32)21-23-10-14-25(15-11-23)34-19-7-5-2/h8-15,20-21,28-29H,4-7,16-19H2,1-3H3/b26-20+,27-21+
C30H37NO3459.61978600
35372456

Double-bond stereo

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C30H37NO3/c1-4-6-18-33-24-12-8-22(9-13-24)20-26-28-16-17-29(31(28)3)27(30(26)32)21-23-10-14-25(15-11-23)34-19-7-5-2/h8-15,20-21,28-29H,4-7,16-19H2,1-3H3
C30H37NO3459.61971100
68061605

Double-bond stereo

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C30H37NO3/c1-4-6-18-33-24-12-8-22(9-13-24)20-26-28-16-17-29(31(28)3)27(30(26)32)21-23-10-14-25(15-11-23)34-19-7-5-2/h8-15,20-21,28-29H,4-7,16-19H2,1-3H3/b26-20+,27-21u
C30H37NO3459.61971100

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