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

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

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC(=N1)C(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])C#N

Isomeric SMILES

CN1C=CC(=N1)C(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])C#N

InChI

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