1-[4-[4-(3-methylpiperidin-1-yl)-3-nitro-phenyl]carbonylpiperazin-1-yl]ethanone

Systemtic Name: 1-[4-[4-(3-methylpiperidin-1-yl)-3-nitro-phenyl]carbonylpiperazin-1-yl]ethanone Openeye Name: 1-[4-[4-(3-methyl-1-piperidyl)-3-nitro-benzoyl]piperazin-1-yl]ethanone CAS Name: 1-[4-[[4-(3-methyl-1-piperidinyl)-3-nitrophenyl]-oxomethyl]-1-piperazinyl]ethanone IUPAC Name: 1-[4-[4-(3-methylpiperidin-1-yl)-3-nitrobenzoyl]piperazin-1-yl]ethanone Traditional Name: 1-[4-[4-(3-methylpiperidino)-3-nitro-benzoyl]piperazino]ethanone Formula: C19H26N4O4 MolecularWeight: 374.43414

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C2=C(C=C(C=C2)C(=O)N3CCN(CC3)C(=O)C)[N+](=O)[O-]

Isomeric SMILES

CC1CCCN(C1)C2=C(C=C(C=C2)C(=O)N3CCN(CC3)C(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C19H26N4O4/c1-14-4-3-7-22(13-14)17-6-5-16(12-18(17)23(26)27)19(25)21-10-8-20(9-11-21)15(2)24/h5-6,12,14H,3-4,7-11,13H2,1-2H3