[2-(3,4-dimethylphenyl)-8-methyl-quinolin-4-yl]-(4-phenylpiperazin-1-yl)methanone

Systemtic Name: [2-(3,4-dimethylphenyl)-8-methyl-quinolin-4-yl]-(4-phenylpiperazin-1-yl)methanone Openeye Name: [2-(3,4-dimethylphenyl)-8-methyl-4-quinolyl]-(4-phenylpiperazin-1-yl)methanone CAS Name: [2-(3,4-dimethylphenyl)-8-methyl-4-quinolinyl]-(4-phenyl-1-piperazinyl)methanone IUPAC Name: [2-(3,4-dimethylphenyl)-8-methylquinolin-4-yl]-(4-phenylpiperazin-1-yl)methanone Traditional Name: [2-(3,4-dimethylphenyl)-8-methyl-4-quinolyl]-(4-phenylpiperazino)methanone Formula: C29H29N3O MolecularWeight: 435.56006

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NC3=C(C=CC=C3C)C(=C2)C(=O)N4CCN(CC4)C5=CC=CC=C5)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NC3=C(C=CC=C3C)C(=C2)C(=O)N4CCN(CC4)C5=CC=CC=C5)C

InChI

InChI=1S/C29H29N3O/c1-20-12-13-23(18-22(20)3)27-19-26(25-11-7-8-21(2)28(25)30-27)29(33)32-16-14-31(15-17-32)24-9-5-4-6-10-24/h4-13,18-19H,14-17H2,1-3H3