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
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Found 3 results

Search term: LQVSAFROWOYFRY (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
10115662

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C29H37N3O3/c33-28(22-6-2-1-3-7-22)31-17-21-16-24(20-31)27-11-10-26(29(34)32(27)18-21)25-9-5-4-8-23(25)19-30-12-14-35-15-13-30/h4-5,8-11,21-22,24H,1-3,6-7,12-20H2/t21-,24+/m0/s1
C29H37N3O3475.62249600
129160804

1 of 2 defined stereocentres - 1/2 defined
InChI=1/C29H37N3O3/c33-28(22-6-2-1-3-7-22)31-17-21-16-24(20-31)27-11-10-26(29(34)32(27)18-21)25-9-5-4-8-23(25)19-30-12-14-35-15-13-30/h4-5,8-11,21-22,24H,1-3,6-7,12-20H2/t21-,24?/m0/s1
C29H37N3O3475.62241100
10115661

Charge

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C29H37N3O3/c33-28(22-6-2-1-3-7-22)31-17-21-16-24(20-31)27-11-10-26(29(34)32(27)18-21)25-9-5-4-8-23(25)19-30-12-14-35-15-13-30/h4-5,8-11,21-22,24H,1-3,6-7,12-20H2/p+1/t21-,24+/m0/s1
C29H38N3O3476.62981100

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