1-(2-oxidanyl-1-phenyl-pyrrol-3-yl)dodecan-1-one

Systemtic Name: 1-(2-oxidanyl-1-phenyl-pyrrol-3-yl)dodecan-1-one Openeye Name: 1-(2-hydroxy-1-phenyl-pyrrol-3-yl)dodecan-1-one CAS Name: 1-(2-hydroxy-1-phenyl-3-pyrrolyl)-1-dodecanone IUPAC Name: 1-(2-hydroxy-1-phenylpyrrol-3-yl)dodecan-1-one Traditional Name: 1-(2-hydroxy-1-phenyl-pyrrol-3-yl)dodecan-1-one Formula: C22H31NO2 MolecularWeight: 341.48704

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)C1=C(N(C=C1)C2=CC=CC=C2)O

Isomeric SMILES

CCCCCCCCCCCC(=O)C1=C(N(C=C1)C2=CC=CC=C2)O

InChI

InChI=1S/C22H31NO2/c1-2-3-4-5-6-7-8-9-13-16-21(24)20-17-18-23(22(20)25)19-14-11-10-12-15-19/h10-12,14-15,17-18,25H,2-9,13,16H2,1H3