1-[4-[4-(4-ethanoylphenyl)piperazin-1-yl]-3-nitro-phenyl]pyrrolidine-2,5-dione

Systemtic Name: 1-[4-[4-(4-ethanoylphenyl)piperazin-1-yl]-3-nitro-phenyl]pyrrolidine-2,5-dione Openeye Name: 1-[4-[4-(4-acetylphenyl)piperazin-1-yl]-3-nitro-phenyl]pyrrolidine-2,5-dione CAS Name: 1-[4-[4-(4-acetylphenyl)-1-piperazinyl]-3-nitrophenyl]pyrrolidine-2,5-dione IUPAC Name: 1-[4-[4-(4-acetylphenyl)piperazin-1-yl]-3-nitrophenyl]pyrrolidine-2,5-dione Traditional Name: 1-[4-[4-(4-acetylphenyl)piperazino]-3-nitro-phenyl]pyrrolidine-2,5-quinone Formula: C22H22N4O5 MolecularWeight: 422.43388

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)N2CCN(CC2)C3=C(C=C(C=C3)N4C(=O)CCC4=O)[N+](=O)[O-]

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)N2CCN(CC2)C3=C(C=C(C=C3)N4C(=O)CCC4=O)[N+](=O)[O-]

InChI

InChI=1S/C22H22N4O5/c1-15(27)16-2-4-17(5-3-16)23-10-12-24(13-11-23)19-7-6-18(14-20(19)26(30)31)25-21(28)8-9-22(25)29/h2-7,14H,8-13H2,1H3