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 6 results

Search term: AATXPCZOCYBGKG (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
3545924

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C29H32N2O2/c1-21-17-22(2)28-26(18-21)27(23-9-5-3-6-10-23)29(24-11-7-4-8-12-24)31(28)20-25(32)19-30-13-15-33-16-14-30/h3-12,17-18,25,32H,13-16,19-20H2,1-2H3
C29H32N2O2440.57658221300
891049

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C29H32N2O2/c1-21-17-22(2)28-26(18-21)27(23-9-5-3-6-10-23)29(24-11-7-4-8-12-24)31(28)20-25(32)19-30-13-15-33-16-14-30/h3-12,17-18,25,32H,13-16,19-20H2,1-2H3/t25-/m1/s1
C29H32N2O2440.57662100
891050

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C29H32N2O2/c1-21-17-22(2)28-26(18-21)27(23-9-5-3-6-10-23)29(24-11-7-4-8-12-24)31(28)20-25(32)19-30-13-15-33-16-14-30/h3-12,17-18,25,32H,13-16,19-20H2,1-2H3/t25-/m0/s1
C29H32N2O2440.57662100
3545923

Charge

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C29H32N2O2/c1-21-17-22(2)28-26(18-21)27(23-9-5-3-6-10-23)29(24-11-7-4-8-12-24)31(28)20-25(32)19-30-13-15-33-16-14-30/h3-12,17-18,25,32H,13-16,19-20H2,1-2H3/p+1
C29H33N2O2441.584521100
5331394

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C29H32N2O2/c1-21-17-22(2)28-26(18-21)27(23-9-5-3-6-10-23)29(24-11-7-4-8-12-24)31(28)20-25(32)19-30-13-15-33-16-14-30/h3-12,17-18,25,32H,13-16,19-20H2,1-2H3/p+1/t25-/m1/s1
C29H33N2O2441.584521100
5331395

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C29H32N2O2/c1-21-17-22(2)28-26(18-21)27(23-9-5-3-6-10-23)29(24-11-7-4-8-12-24)31(28)20-25(32)19-30-13-15-33-16-14-30/h3-12,17-18,25,32H,13-16,19-20H2,1-2H3/p+1/t25-/m0/s1
C29H33N2O2441.584521100

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