1-(3,5-dimethylpiperidin-1-yl)-2-[4-[2-nitro-4-(phenylcarbonyl)phenyl]piperazin-1-yl]ethanone

Systemtic Name: 1-(3,5-dimethylpiperidin-1-yl)-2-[4-[2-nitro-4-(phenylcarbonyl)phenyl]piperazin-1-yl]ethanone Openeye Name: 2-[4-(4-benzoyl-2-nitro-phenyl)piperazin-1-yl]-1-(3,5-dimethyl-1-piperidyl)ethanone CAS Name: 2-[4-(4-benzoyl-2-nitrophenyl)-1-piperazinyl]-1-(3,5-dimethyl-1-piperidinyl)ethanone IUPAC Name: 2-[4-(4-benzoyl-2-nitrophenyl)piperazin-1-yl]-1-(3,5-dimethylpiperidin-1-yl)ethanone Traditional Name: 2-[4-(4-benzoyl-2-nitro-phenyl)piperazino]-1-(3,5-dimethylpiperidino)ethanone Formula: C26H32N4O4 MolecularWeight: 464.55668

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)C(=O)CN2CCN(CC2)C3=C(C=C(C=C3)C(=O)C4=CC=CC=C4)[N+](=O)[O-])C

Isomeric SMILES

CC1CC(CN(C1)C(=O)CN2CCN(CC2)C3=C(C=C(C=C3)C(=O)C4=CC=CC=C4)[N+](=O)[O-])C

InChI

InChI=1S/C26H32N4O4/c1-19-14-20(2)17-29(16-19)25(31)18-27-10-12-28(13-11-27)23-9-8-22(15-24(23)30(33)34)26(32)21-6-4-3-5-7-21/h3-9,15,19-20H,10-14,16-18H2,1-2H3