4-(4-ethanoyl-2-nitro-phenyl)piperazin-2-one

Systemtic Name: 4-(4-ethanoyl-2-nitro-phenyl)piperazin-2-one Openeye Name: 4-(4-acetyl-2-nitro-phenyl)piperazin-2-one CAS Name: 4-(4-acetyl-2-nitrophenyl)-2-piperazinone IUPAC Name: 4-(4-acetyl-2-nitrophenyl)piperazin-2-one Traditional Name: 4-(4-acetyl-2-nitro-phenyl)piperazin-2-one Formula: C12H13N3O4 MolecularWeight: 263.24932

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)N2CCNC(=O)C2)[N+](=O)[O-]

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)N2CCNC(=O)C2)[N+](=O)[O-]

InChI

InChI=1S/C12H13N3O4/c1-8(16)9-2-3-10(11(6-9)15(18)19)14-5-4-13-12(17)7-14/h2-3,6H,4-5,7H2,1H3,(H,13,17)