N-(1-methyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-3,5-dinitro-benzamide

Systemtic Name: N-(1-methyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-3,5-dinitro-benzamide Openeye Name: N-(1-methyl-3-oxo-2-phenyl-pyrazol-4-yl)-3,5-dinitro-benzamide CAS Name: N-(1-methyl-3-oxo-2-phenyl-4-pyrazolyl)-3,5-dinitrobenzamide IUPAC Name: N-(1-methyl-3-oxo-2-phenylpyrazol-4-yl)-3,5-dinitrobenzamide Traditional Name: N-(3-keto-1-methyl-2-phenyl-3-pyrazolin-4-yl)-3,5-dinitro-benzamide Formula: C17H13N5O6 MolecularWeight: 383.31502

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=O)N1C2=CC=CC=C2)NC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CN1C=C(C(=O)N1C2=CC=CC=C2)NC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C17H13N5O6/c1-19-10-15(17(24)20(19)12-5-3-2-4-6-12)18-16(23)11-7-13(21(25)26)9-14(8-11)22(27)28/h2-10H,1H3,(H,18,23)