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

Systemtic Name: [2-(3,4-dimethylphenyl)-8-methyl-quinolin-4-yl]-[4-(diphenylmethyl)piperazin-1-yl]methanone Openeye Name: (4-benzhydrylpiperazin-1-yl)-[2-(3,4-dimethylphenyl)-8-methyl-4-quinolyl]methanone CAS Name: [2-(3,4-dimethylphenyl)-8-methyl-4-quinolinyl]-[4-(diphenylmethyl)-1-piperazinyl]methanone IUPAC Name: (4-benzhydrylpiperazin-1-yl)-[2-(3,4-dimethylphenyl)-8-methylquinolin-4-yl]methanone Traditional Name: (4-benzhydrylpiperazino)-[2-(3,4-dimethylphenyl)-8-methyl-4-quinolyl]methanone Formula: C36H35N3O MolecularWeight: 525.6826

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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)C(C5=CC=CC=C5)C6=CC=CC=C6)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NC3=C(C=CC=C3C)C(=C2)C(=O)N4CCN(CC4)C(C5=CC=CC=C5)C6=CC=CC=C6)C

InChI

InChI=1S/C36H35N3O/c1-25-17-18-30(23-27(25)3)33-24-32(31-16-10-11-26(2)34(31)37-33)36(40)39-21-19-38(20-22-39)35(28-12-6-4-7-13-28)29-14-8-5-9-15-29/h4-18,23-24,35H,19-22H2,1-3H3