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

Systemtic Name: 6-[4-(3,4-dimethylphenyl)carbonylpiperazin-1-yl]-1-(phenylmethyl)-3,4-dihydroquinolin-2-one Openeye Name: 1-benzyl-6-[4-(3,4-dimethylbenzoyl)piperazin-1-yl]-3,4-dihydroquinolin-2-one CAS Name: 6-[4-[(3,4-dimethylphenyl)-oxomethyl]-1-piperazinyl]-1-(phenylmethyl)-3,4-dihydroquinolin-2-one IUPAC Name: 1-benzyl-6-[4-(3,4-dimethylbenzoyl)piperazin-1-yl]-3,4-dihydroquinolin-2-one Traditional Name: 1-benzyl-6-[4-(3,4-dimethylbenzoyl)piperazino]-3,4-dihydrocarbostyril Formula: C29H31N3O2 MolecularWeight: 453.57534

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C3=CC4=C(C=C3)N(C(=O)CC4)CC5=CC=CC=C5)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C3=CC4=C(C=C3)N(C(=O)CC4)CC5=CC=CC=C5)C

InChI

InChI=1S/C29H31N3O2/c1-21-8-9-25(18-22(21)2)29(34)31-16-14-30(15-17-31)26-11-12-27-24(19-26)10-13-28(33)32(27)20-23-6-4-3-5-7-23/h3-9,11-12,18-19H,10,13-17,20H2,1-2H3