[4-(3,5-dimethylpiperidin-1-yl)-3-nitro-phenyl]-[4-(3-methoxyphenyl)piperazin-1-yl]methanone

Systemtic Name: [4-(3,5-dimethylpiperidin-1-yl)-3-nitro-phenyl]-[4-(3-methoxyphenyl)piperazin-1-yl]methanone Openeye Name: [4-(3,5-dimethyl-1-piperidyl)-3-nitro-phenyl]-[4-(3-methoxyphenyl)piperazin-1-yl]methanone CAS Name: [4-(3,5-dimethyl-1-piperidinyl)-3-nitrophenyl]-[4-(3-methoxyphenyl)-1-piperazinyl]methanone IUPAC Name: [4-(3,5-dimethylpiperidin-1-yl)-3-nitrophenyl]-[4-(3-methoxyphenyl)piperazin-1-yl]methanone Traditional Name: [4-(3,5-dimethylpiperidino)-3-nitro-phenyl]-[4-(3-methoxyphenyl)piperazino]methanone Formula: C25H32N4O4 MolecularWeight: 452.54598

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)C2=C(C=C(C=C2)C(=O)N3CCN(CC3)C4=CC(=CC=C4)OC)[N+](=O)[O-])C

Isomeric SMILES

CC1CC(CN(C1)C2=C(C=C(C=C2)C(=O)N3CCN(CC3)C4=CC(=CC=C4)OC)[N+](=O)[O-])C

InChI

InChI=1S/C25H32N4O4/c1-18-13-19(2)17-28(16-18)23-8-7-20(14-24(23)29(31)32)25(30)27-11-9-26(10-12-27)21-5-4-6-22(15-21)33-3/h4-8,14-15,18-19H,9-13,16-17H2,1-3H3