N-[2-(3,5-dimethylpiperidin-1-yl)-4-methyl-quinolin-6-yl]-4-[4-(4-nitrophenyl)piperazin-1-yl]-4-oxidanylidene-butanamide

Systemtic Name: N-[2-(3,5-dimethylpiperidin-1-yl)-4-methyl-quinolin-6-yl]-4-[4-(4-nitrophenyl)piperazin-1-yl]-4-oxidanylidene-butanamide Openeye Name: N-[2-(3,5-dimethyl-1-piperidyl)-4-methyl-6-quinolyl]-4-[4-(4-nitrophenyl)piperazin-1-yl]-4-oxo-butanamide CAS Name: N-[2-(3,5-dimethyl-1-piperidinyl)-4-methyl-6-quinolinyl]-4-[4-(4-nitrophenyl)-1-piperazinyl]-4-oxobutanamide IUPAC Name: N-[2-(3,5-dimethylpiperidin-1-yl)-4-methylquinolin-6-yl]-4-[4-(4-nitrophenyl)piperazin-1-yl]-4-oxobutanamide Traditional Name: N-[2-(3,5-dimethylpiperidino)-4-methyl-6-quinolyl]-4-keto-4-[4-(4-nitrophenyl)piperazino]butyramide Formula: C31H38N6O4 MolecularWeight: 558.67122

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)C2=NC3=C(C=C(C=C3)NC(=O)CCC(=O)N4CCN(CC4)C5=CC=C(C=C5)[N+](=O)[O-])C(=C2)C)C

Isomeric SMILES

CC1CC(CN(C1)C2=NC3=C(C=C(C=C3)NC(=O)CCC(=O)N4CCN(CC4)C5=CC=C(C=C5)[N+](=O)[O-])C(=C2)C)C

InChI

InChI=1S/C31H38N6O4/c1-21-16-22(2)20-36(19-21)29-17-23(3)27-18-24(4-9-28(27)33-29)32-30(38)10-11-31(39)35-14-12-34(13-15-35)25-5-7-26(8-6-25)37(40)41/h4-9,17-18,21-22H,10-16,19-20H2,1-3H3,(H,32,38)