3-(3,4-dimethoxyphenyl)carbonyl-1-(phenylmethyl)quinolin-4-one

Systemtic Name: 3-(3,4-dimethoxyphenyl)carbonyl-1-(phenylmethyl)quinolin-4-one Openeye Name: 1-benzyl-3-(3,4-dimethoxybenzoyl)quinolin-4-one CAS Name: 3-[(3,4-dimethoxyphenyl)-oxomethyl]-1-(phenylmethyl)-4-quinolinone IUPAC Name: 1-benzyl-3-(3,4-dimethoxybenzoyl)quinolin-4-one Traditional Name: 1-benzyl-3-veratroyl-4-quinolone Formula: C25H21NO4 MolecularWeight: 399.43854

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)C2=CN(C3=CC=CC=C3C2=O)CC4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)C2=CN(C3=CC=CC=C3C2=O)CC4=CC=CC=C4)OC

InChI

InChI=1S/C25H21NO4/c1-29-22-13-12-18(14-23(22)30-2)24(27)20-16-26(15-17-8-4-3-5-9-17)21-11-7-6-10-19(21)25(20)28/h3-14,16H,15H2,1-2H3