[2-(3,4-dimethylphenyl)-2-oxidanylidene-ethyl] 4-(3-ethanoyl-2-methyl-5-phenyl-pyrrol-1-yl)benzoate

Systemtic Name: [2-(3,4-dimethylphenyl)-2-oxidanylidene-ethyl] 4-(3-ethanoyl-2-methyl-5-phenyl-pyrrol-1-yl)benzoate Openeye Name: [2-(3,4-dimethylphenyl)-2-oxo-ethyl] 4-(3-acetyl-2-methyl-5-phenyl-pyrrol-1-yl)benzoate CAS Name: 4-(3-acetyl-2-methyl-5-phenyl-1-pyrrolyl)benzoic acid [2-(3,4-dimethylphenyl)-2-oxoethyl] ester IUPAC Name: [2-(3,4-dimethylphenyl)-2-oxoethyl] 4-(3-acetyl-2-methyl-5-phenylpyrrol-1-yl)benzoate Traditional Name: 4-(3-acetyl-2-methyl-5-phenyl-pyrrol-1-yl)benzoic acid [2-(3,4-dimethylphenyl)-2-keto-ethyl] ester Formula: C30H27NO4 MolecularWeight: 465.53968

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)COC(=O)C2=CC=C(C=C2)N3C(=C(C=C3C4=CC=CC=C4)C(=O)C)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)COC(=O)C2=CC=C(C=C2)N3C(=C(C=C3C4=CC=CC=C4)C(=O)C)C)C

InChI

InChI=1S/C30H27NO4/c1-19-10-11-25(16-20(19)2)29(33)18-35-30(34)24-12-14-26(15-13-24)31-21(3)27(22(4)32)17-28(31)23-8-6-5-7-9-23/h5-17H,18H2,1-4H3