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

Systemtic Name: 6-[4-[(3,4-dimethylphenyl)methyl]piperazin-1-yl]-1-(phenylmethyl)-3,4-dihydroquinolin-2-one Openeye Name: 1-benzyl-6-[4-[(3,4-dimethylphenyl)methyl]piperazin-1-yl]-3,4-dihydroquinolin-2-one CAS Name: 6-[4-[(3,4-dimethylphenyl)methyl]-1-piperazinyl]-1-(phenylmethyl)-3,4-dihydroquinolin-2-one IUPAC Name: 1-benzyl-6-[4-[(3,4-dimethylphenyl)methyl]piperazin-1-yl]-3,4-dihydroquinolin-2-one Traditional Name: 1-benzyl-6-[4-(3,4-dimethylbenzyl)piperazino]-3,4-dihydrocarbostyril Formula: C29H33N3O MolecularWeight: 439.59182

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CN2CCN(CC2)C3=CC4=C(C=C3)N(C(=O)CC4)CC5=CC=CC=C5)C

Isomeric SMILES

CC1=C(C=C(C=C1)CN2CCN(CC2)C3=CC4=C(C=C3)N(C(=O)CC4)CC5=CC=CC=C5)C

InChI

InChI=1S/C29H33N3O/c1-22-8-9-25(18-23(22)2)20-30-14-16-31(17-15-30)27-11-12-28-26(19-27)10-13-29(33)32(28)21-24-6-4-3-5-7-24/h3-9,11-12,18-19H,10,13-17,20-21H2,1-2H3