1-(3-nitro-4-piperidin-1-yl-phenyl)-3-[4-(phenylcarbonyl)piperazin-1-yl]propan-1-one

Systemtic Name: 1-(3-nitro-4-piperidin-1-yl-phenyl)-3-[4-(phenylcarbonyl)piperazin-1-yl]propan-1-one Openeye Name: 3-(4-benzoylpiperazin-1-yl)-1-[3-nitro-4-(1-piperidyl)phenyl]propan-1-one CAS Name: 3-(4-benzoyl-1-piperazinyl)-1-[3-nitro-4-(1-piperidinyl)phenyl]-1-propanone IUPAC Name: 3-(4-benzoylpiperazin-1-yl)-1-(3-nitro-4-piperidin-1-ylphenyl)propan-1-one Traditional Name: 3-(4-benzoylpiperazino)-1-(3-nitro-4-piperidino-phenyl)propan-1-one Formula: C25H30N4O4 MolecularWeight: 450.5301

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C=C(C=C2)C(=O)CCN3CCN(CC3)C(=O)C4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)C2=C(C=C(C=C2)C(=O)CCN3CCN(CC3)C(=O)C4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C25H30N4O4/c30-24(21-9-10-22(23(19-21)29(32)33)27-12-5-2-6-13-27)11-14-26-15-17-28(18-16-26)25(31)20-7-3-1-4-8-20/h1,3-4,7-10,19H,2,5-6,11-18H2