N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-5-nitro-2-(phenylmethyl)pyrazole-3-carboxamide

Systemtic Name: N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-5-nitro-2-(phenylmethyl)pyrazole-3-carboxamide Openeye Name: 2-benzyl-N-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-5-nitro-pyrazole-3-carboxamide CAS Name: N-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-5-nitro-2-(phenylmethyl)-3-pyrazolecarboxamide IUPAC Name: 2-benzyl-N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-5-nitropyrazole-3-carboxamide Traditional Name: 2-benzyl-N-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)-5-nitro-pyrazole-3-carboxamide Formula: C22H20N6O4 MolecularWeight: 432.432

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)C3=CC(=NN3CC4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)C3=CC(=NN3CC4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H20N6O4/c1-15-20(22(30)27(25(15)2)17-11-7-4-8-12-17)23-21(29)18-13-19(28(31)32)24-26(18)14-16-9-5-3-6-10-16/h3-13H,14H2,1-2H3,(H,23,29)