4-nitro-N-[3-[(4-nitrophenyl)carbonylamino]-1H-1,2,4-triazol-5-yl]benzamide

Systemtic Name: 4-nitro-N-[3-[(4-nitrophenyl)carbonylamino]-1H-1,2,4-triazol-5-yl]benzamide Openeye Name: 4-nitro-N-[3-[(4-nitrobenzoyl)amino]-1H-1,2,4-triazol-5-yl]benzamide CAS Name: 4-nitro-N-[3-[[(4-nitrophenyl)-oxomethyl]amino]-1H-1,2,4-triazol-5-yl]benzamide IUPAC Name: 4-nitro-N-[3-[(4-nitrobenzoyl)amino]-1H-1,2,4-triazol-5-yl]benzamide Traditional Name: 4-nitro-N-[3-[(4-nitrobenzoyl)amino]-1H-1,2,4-triazol-5-yl]benzamide Formula: C16H11N7O6 MolecularWeight: 397.30184

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)NC2=NC(=NN2)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C(=O)NC2=NC(=NN2)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C16H11N7O6/c24-13(9-1-5-11(6-2-9)22(26)27)17-15-19-16(21-20-15)18-14(25)10-3-7-12(8-4-10)23(28)29/h1-8H,(H3,17,18,19,20,21,24,25)