6-[4-[(3,4-dimethoxyphenyl)methyl]piperazin-1-yl]-1-(phenylmethyl)-3,4-dihydroquinolin-2-one

Systemtic Name: 6-[4-[(3,4-dimethoxyphenyl)methyl]piperazin-1-yl]-1-(phenylmethyl)-3,4-dihydroquinolin-2-one Openeye Name: 1-benzyl-6-[4-[(3,4-dimethoxyphenyl)methyl]piperazin-1-yl]-3,4-dihydroquinolin-2-one CAS Name: 6-[4-[(3,4-dimethoxyphenyl)methyl]-1-piperazinyl]-1-(phenylmethyl)-3,4-dihydroquinolin-2-one IUPAC Name: 1-benzyl-6-[4-[(3,4-dimethoxyphenyl)methyl]piperazin-1-yl]-3,4-dihydroquinolin-2-one Traditional Name: 1-benzyl-6-(4-veratrylpiperazino)-3,4-dihydrocarbostyril Formula: C29H33N3O3 MolecularWeight: 471.59062

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN2CCN(CC2)C3=CC4=C(C=C3)N(C(=O)CC4)CC5=CC=CC=C5)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CN2CCN(CC2)C3=CC4=C(C=C3)N(C(=O)CC4)CC5=CC=CC=C5)OC

InChI

InChI=1S/C29H33N3O3/c1-34-27-12-8-23(18-28(27)35-2)20-30-14-16-31(17-15-30)25-10-11-26-24(19-25)9-13-29(33)32(26)21-22-6-4-3-5-7-22/h3-8,10-12,18-19H,9,13-17,20-21H2,1-2H3