[2-(4-methoxyphenyl)-6-methyl-quinolin-4-yl]-[4-(phenylmethyl)piperazin-1-yl]methanone

Systemtic Name: [2-(4-methoxyphenyl)-6-methyl-quinolin-4-yl]-[4-(phenylmethyl)piperazin-1-yl]methanone Openeye Name: (4-benzylpiperazin-1-yl)-[2-(4-methoxyphenyl)-6-methyl-4-quinolyl]methanone CAS Name: [2-(4-methoxyphenyl)-6-methyl-4-quinolinyl]-[4-(phenylmethyl)-1-piperazinyl]methanone IUPAC Name: (4-benzylpiperazin-1-yl)-[2-(4-methoxyphenyl)-6-methylquinolin-4-yl]methanone Traditional Name: (4-benzylpiperazino)-[2-(4-methoxyphenyl)-6-methyl-4-quinolyl]methanone Formula: C29H29N3O2 MolecularWeight: 451.55946

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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)OC

Isomeric SMILES

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

InChI

InChI=1S/C29H29N3O2/c1-21-8-13-27-25(18-21)26(19-28(30-27)23-9-11-24(34-2)12-10-23)29(33)32-16-14-31(15-17-32)20-22-6-4-3-5-7-22/h3-13,18-19H,14-17,20H2,1-2H3