[4-(2,3-dimethylphenyl)piperazin-1-yl]-[2-(3-methoxyphenyl)quinolin-4-yl]methanone

Systemtic Name: [4-(2,3-dimethylphenyl)piperazin-1-yl]-[2-(3-methoxyphenyl)quinolin-4-yl]methanone Openeye Name: [4-(2,3-dimethylphenyl)piperazin-1-yl]-[2-(3-methoxyphenyl)-4-quinolyl]methanone CAS Name: [4-(2,3-dimethylphenyl)-1-piperazinyl]-[2-(3-methoxyphenyl)-4-quinolinyl]methanone IUPAC Name: [4-(2,3-dimethylphenyl)piperazin-1-yl]-[2-(3-methoxyphenyl)quinolin-4-yl]methanone Traditional Name: [4-(2,3-dimethylphenyl)piperazino]-[2-(3-methoxyphenyl)-4-quinolyl]methanone Formula: C29H29N3O2 MolecularWeight: 451.55946

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)C3=CC(=NC4=CC=CC=C43)C5=CC(=CC=C5)OC)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)C3=CC(=NC4=CC=CC=C43)C5=CC(=CC=C5)OC)C

InChI

InChI=1S/C29H29N3O2/c1-20-8-6-13-28(21(20)2)31-14-16-32(17-15-31)29(33)25-19-27(22-9-7-10-23(18-22)34-3)30-26-12-5-4-11-24(25)26/h4-13,18-19H,14-17H2,1-3H3