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

Systemtic Name: 1-[4-(4-imidazol-1-yl-3-nitro-phenyl)carbonylpiperazin-1-yl]ethanone Openeye Name: 1-[4-(4-imidazol-1-yl-3-nitro-benzoyl)piperazin-1-yl]ethanone CAS Name: 1-[4-[[4-(1-imidazolyl)-3-nitrophenyl]-oxomethyl]-1-piperazinyl]ethanone IUPAC Name: 1-[4-(4-imidazol-1-yl-3-nitrobenzoyl)piperazin-1-yl]ethanone Traditional Name: 1-[4-(4-imidazol-1-yl-3-nitro-benzoyl)piperazino]ethanone Formula: C16H17N5O4 MolecularWeight: 343.33728

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C(=O)C2=CC(=C(C=C2)N3C=CN=C3)[N+](=O)[O-]

Isomeric SMILES

CC(=O)N1CCN(CC1)C(=O)C2=CC(=C(C=C2)N3C=CN=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H17N5O4/c1-12(22)18-6-8-19(9-7-18)16(23)13-2-3-14(15(10-13)21(24)25)20-5-4-17-11-20/h2-5,10-11H,6-9H2,1H3