N-(2-cyanophenyl)-1-methyl-4-nitro-pyrazole-3-carboxamide

Systemtic Name: N-(2-cyanophenyl)-1-methyl-4-nitro-pyrazole-3-carboxamide Openeye Name: N-(2-cyanophenyl)-1-methyl-4-nitro-pyrazole-3-carboxamide CAS Name: N-(2-cyanophenyl)-1-methyl-4-nitro-3-pyrazolecarboxamide IUPAC Name: N-(2-cyanophenyl)-1-methyl-4-nitropyrazole-3-carboxamide Traditional Name: N-(2-cyanophenyl)-1-methyl-4-nitro-pyrazole-3-carboxamide Formula: C12H9N5O3 MolecularWeight: 271.23156

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=N1)C(=O)NC2=CC=CC=C2C#N)[N+](=O)[O-]

Isomeric SMILES

CN1C=C(C(=N1)C(=O)NC2=CC=CC=C2C#N)[N+](=O)[O-]

InChI

InChI=1S/C12H9N5O3/c1-16-7-10(17(19)20)11(15-16)12(18)14-9-5-3-2-4-8(9)6-13/h2-5,7H,1H3,(H,14,18)