[2-(3-methylphenyl)quinolin-4-yl]-[4-(4-nitrophenyl)piperazin-1-yl]methanone

Systemtic Name: [2-(3-methylphenyl)quinolin-4-yl]-[4-(4-nitrophenyl)piperazin-1-yl]methanone Openeye Name: [2-(m-tolyl)-4-quinolyl]-[4-(4-nitrophenyl)piperazin-1-yl]methanone CAS Name: [2-(3-methylphenyl)-4-quinolinyl]-[4-(4-nitrophenyl)-1-piperazinyl]methanone IUPAC Name: [2-(3-methylphenyl)quinolin-4-yl]-[4-(4-nitrophenyl)piperazin-1-yl]methanone Traditional Name: [2-(m-tolyl)-4-quinolyl]-[4-(4-nitrophenyl)piperazino]methanone Formula: C27H24N4O3 MolecularWeight: 452.50446

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)N4CCN(CC4)C5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC(=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)N4CCN(CC4)C5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C27H24N4O3/c1-19-5-4-6-20(17-19)26-18-24(23-7-2-3-8-25(23)28-26)27(32)30-15-13-29(14-16-30)21-9-11-22(12-10-21)31(33)34/h2-12,17-18H,13-16H2,1H3