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

Systemtic Name: N-(4-cyano-2-phenyl-pyrazol-3-yl)-2,5-dimethyl-4-nitro-pyrazole-3-carboxamide Openeye Name: N-(4-cyano-2-phenyl-pyrazol-3-yl)-2,5-dimethyl-4-nitro-pyrazole-3-carboxamide CAS Name: N-(4-cyano-2-phenyl-3-pyrazolyl)-2,5-dimethyl-4-nitro-3-pyrazolecarboxamide IUPAC Name: N-(4-cyano-2-phenylpyrazol-3-yl)-2,5-dimethyl-4-nitropyrazole-3-carboxamide Traditional Name: N-(4-cyano-2-phenyl-pyrazol-3-yl)-2,5-dimethyl-4-nitro-pyrazole-3-carboxamide Formula: C16H13N7O3 MolecularWeight: 351.31952

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1[N+](=O)[O-])C(=O)NC2=C(C=NN2C3=CC=CC=C3)C#N)C

Isomeric SMILES

CC1=NN(C(=C1[N+](=O)[O-])C(=O)NC2=C(C=NN2C3=CC=CC=C3)C#N)C

InChI

InChI=1S/C16H13N7O3/c1-10-13(23(25)26)14(21(2)20-10)16(24)19-15-11(8-17)9-18-22(15)12-6-4-3-5-7-12/h3-7,9H,1-2H3,(H,19,24)