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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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