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

Systemtic Name: [2-(3,4-dimethylphenyl)-8-methyl-quinolin-4-yl]-[4-(4-nitrophenyl)piperazin-1-yl]methanone Openeye Name: [2-(3,4-dimethylphenyl)-8-methyl-4-quinolyl]-[4-(4-nitrophenyl)piperazin-1-yl]methanone CAS Name: [2-(3,4-dimethylphenyl)-8-methyl-4-quinolinyl]-[4-(4-nitrophenyl)-1-piperazinyl]methanone IUPAC Name: [2-(3,4-dimethylphenyl)-8-methylquinolin-4-yl]-[4-(4-nitrophenyl)piperazin-1-yl]methanone Traditional Name: [2-(3,4-dimethylphenyl)-8-methyl-4-quinolyl]-[4-(4-nitrophenyl)piperazino]methanone Formula: C29H28N4O3 MolecularWeight: 480.55762

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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=C(C=C5)[N+](=O)[O-])C

Isomeric SMILES

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

InChI

InChI=1S/C29H28N4O3/c1-19-7-8-22(17-21(19)3)27-18-26(25-6-4-5-20(2)28(25)30-27)29(34)32-15-13-31(14-16-32)23-9-11-24(12-10-23)33(35)36/h4-12,17-18H,13-16H2,1-3H3