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

Systemtic Name: 6-[4-(3,4-dimethoxyphenyl)carbonylpiperazin-1-yl]-1-[(4-hydroxyphenyl)methyl]-3,4-dihydroquinolin-2-one Openeye Name: 6-[4-(3,4-dimethoxybenzoyl)piperazin-1-yl]-1-[(4-hydroxyphenyl)methyl]-3,4-dihydroquinolin-2-one CAS Name: 6-[4-[(3,4-dimethoxyphenyl)-oxomethyl]-1-piperazinyl]-1-[(4-hydroxyphenyl)methyl]-3,4-dihydroquinolin-2-one IUPAC Name: 6-[4-(3,4-dimethoxybenzoyl)piperazin-1-yl]-1-[(4-hydroxyphenyl)methyl]-3,4-dihydroquinolin-2-one Traditional Name: 1-(4-hydroxybenzyl)-6-(4-veratroylpiperazino)-3,4-dihydrocarbostyril Formula: C29H31N3O5 MolecularWeight: 501.57354

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C3=CC4=C(C=C3)N(C(=O)CC4)CC5=CC=C(C=C5)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C3=CC4=C(C=C3)N(C(=O)CC4)CC5=CC=C(C=C5)O)OC

InChI

InChI=1S/C29H31N3O5/c1-36-26-11-5-22(18-27(26)37-2)29(35)31-15-13-30(14-16-31)23-7-10-25-21(17-23)6-12-28(34)32(25)19-20-3-8-24(33)9-4-20/h3-5,7-11,17-18,33H,6,12-16,19H2,1-2H3