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

Systemtic Name: [4-(4-imidazol-1-yl-3-nitro-phenyl)carbonylpiperazin-1-yl]-phenyl-methanone Openeye Name: [4-(4-imidazol-1-yl-3-nitro-benzoyl)piperazin-1-yl]-phenyl-methanone CAS Name: [4-[[4-(1-imidazolyl)-3-nitrophenyl]-oxomethyl]-1-piperazinyl]-phenylmethanone IUPAC Name: [4-(4-imidazol-1-yl-3-nitrobenzoyl)piperazin-1-yl]-phenylmethanone Traditional Name: [4-(4-imidazol-1-yl-3-nitro-benzoyl)piperazino]-phenyl-methanone Formula: C21H19N5O4 MolecularWeight: 405.40666

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC=CC=C2)C(=O)C3=CC(=C(C=C3)N4C=CN=C4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC=CC=C2)C(=O)C3=CC(=C(C=C3)N4C=CN=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H19N5O4/c27-20(16-4-2-1-3-5-16)23-10-12-24(13-11-23)21(28)17-6-7-18(19(14-17)26(29)30)25-9-8-22-15-25/h1-9,14-15H,10-13H2