1-[3-nitro-4-[4-(phenylcarbonyl)piperazin-1-yl]phenyl]ethanone

Systemtic Name: 1-[3-nitro-4-[4-(phenylcarbonyl)piperazin-1-yl]phenyl]ethanone Openeye Name: 1-[4-(4-benzoylpiperazin-1-yl)-3-nitro-phenyl]ethanone CAS Name: 1-[4-(4-benzoyl-1-piperazinyl)-3-nitrophenyl]ethanone IUPAC Name: 1-[4-(4-benzoylpiperazin-1-yl)-3-nitrophenyl]ethanone Traditional Name: 1-[4-(4-benzoylpiperazino)-3-nitro-phenyl]ethanone Formula: C19H19N3O4 MolecularWeight: 353.37186

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)N2CCN(CC2)C(=O)C3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)N2CCN(CC2)C(=O)C3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H19N3O4/c1-14(23)16-7-8-17(18(13-16)22(25)26)20-9-11-21(12-10-20)19(24)15-5-3-2-4-6-15/h2-8,13H,9-12H2,1H3