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

Systemtic Name: [2-(3,4-dimethylphenyl)-6-methyl-quinolin-4-yl]-[4-(phenylmethyl)piperazin-1-yl]methanone Openeye Name: (4-benzylpiperazin-1-yl)-[2-(3,4-dimethylphenyl)-6-methyl-4-quinolyl]methanone CAS Name: [2-(3,4-dimethylphenyl)-6-methyl-4-quinolinyl]-[4-(phenylmethyl)-1-piperazinyl]methanone IUPAC Name: (4-benzylpiperazin-1-yl)-[2-(3,4-dimethylphenyl)-6-methylquinolin-4-yl]methanone Traditional Name: (4-benzylpiperazino)-[2-(3,4-dimethylphenyl)-6-methyl-4-quinolyl]methanone Formula: C30H31N3O MolecularWeight: 449.58664

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(C=C2C(=O)N3CCN(CC3)CC4=CC=CC=C4)C5=CC(=C(C=C5)C)C

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(C=C2C(=O)N3CCN(CC3)CC4=CC=CC=C4)C5=CC(=C(C=C5)C)C

InChI

InChI=1S/C30H31N3O/c1-21-9-12-28-26(17-21)27(19-29(31-28)25-11-10-22(2)23(3)18-25)30(34)33-15-13-32(14-16-33)20-24-7-5-4-6-8-24/h4-12,17-19H,13-16,20H2,1-3H3