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

Systemtic Name: N-(2-cyano-4-nitro-phenyl)-1,3-dimethyl-pyrazole-4-carboxamide Openeye Name: N-(2-cyano-4-nitro-phenyl)-1,3-dimethyl-pyrazole-4-carboxamide CAS Name: N-(2-cyano-4-nitrophenyl)-1,3-dimethyl-4-pyrazolecarboxamide IUPAC Name: N-(2-cyano-4-nitrophenyl)-1,3-dimethylpyrazole-4-carboxamide Traditional Name: N-(2-cyano-4-nitro-phenyl)-1,3-dimethyl-pyrazole-4-carboxamide Formula: C13H11N5O3 MolecularWeight: 285.25814

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1C(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])C#N)C

Isomeric SMILES

CC1=NN(C=C1C(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])C#N)C

InChI

InChI=1S/C13H11N5O3/c1-8-11(7-17(2)16-8)13(19)15-12-4-3-10(18(20)21)5-9(12)6-14/h3-5,7H,1-2H3,(H,15,19)