2-[1-(2-azanyl-4-methyl-phenyl)-2,5-diphenyl-pyrrol-3-yl]-5,5-dimethyl-3-oxidanyl-cyclohex-2-en-1-one

Systemtic Name: 2-[1-(2-azanyl-4-methyl-phenyl)-2,5-diphenyl-pyrrol-3-yl]-5,5-dimethyl-3-oxidanyl-cyclohex-2-en-1-one Openeye Name: 2-[1-(2-amino-4-methyl-phenyl)-2,5-diphenyl-pyrrol-3-yl]-3-hydroxy-5,5-dimethyl-cyclohex-2-en-1-one CAS Name: 2-[1-(2-amino-4-methylphenyl)-2,5-diphenyl-3-pyrrolyl]-3-hydroxy-5,5-dimethyl-1-cyclohex-2-enone IUPAC Name: 2-[1-(2-amino-4-methylphenyl)-2,5-diphenylpyrrol-3-yl]-3-hydroxy-5,5-dimethylcyclohex-2-en-1-one Traditional Name: 2-[1-(2-amino-4-methyl-phenyl)-2,5-diphenyl-pyrrol-3-yl]-3-hydroxy-5,5-dimethyl-cyclohex-2-en-1-one Formula: C31H30N2O2 MolecularWeight: 462.5821

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2C(=CC(=C2C3=CC=CC=C3)C4=C(CC(CC4=O)(C)C)O)C5=CC=CC=C5)N

Isomeric SMILES

CC1=CC(=C(C=C1)N2C(=CC(=C2C3=CC=CC=C3)C4=C(CC(CC4=O)(C)C)O)C5=CC=CC=C5)N

InChI

InChI=1S/C31H30N2O2/c1-20-14-15-25(24(32)16-20)33-26(21-10-6-4-7-11-21)17-23(30(33)22-12-8-5-9-13-22)29-27(34)18-31(2,3)19-28(29)35/h4-17,34H,18-19,32H2,1-3H3