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

Systemtic Name: 1-[4-(4-ethanoylpiperazin-1-yl)-3-nitro-phenyl]ethanone Openeye Name: 1-[4-(4-acetylpiperazin-1-yl)-3-nitro-phenyl]ethanone CAS Name: 1-[4-(4-acetyl-1-piperazinyl)-3-nitrophenyl]ethanone IUPAC Name: 1-[4-(4-acetylpiperazin-1-yl)-3-nitrophenyl]ethanone Traditional Name: 1-[4-(4-acetylpiperazino)-3-nitro-phenyl]ethanone Formula: C14H17N3O4 MolecularWeight: 291.30248

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H17N3O4/c1-10(18)12-3-4-13(14(9-12)17(20)21)16-7-5-15(6-8-16)11(2)19/h3-4,9H,5-8H2,1-2H3