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

Systemtic Name: N-(2-cyano-4-nitro-phenyl)-2,5-dimethyl-pyrazole-3-carboxamide Openeye Name: N-(2-cyano-4-nitro-phenyl)-2,5-dimethyl-pyrazole-3-carboxamide CAS Name: N-(2-cyano-4-nitrophenyl)-2,5-dimethyl-3-pyrazolecarboxamide IUPAC Name: N-(2-cyano-4-nitrophenyl)-2,5-dimethylpyrazole-3-carboxamide Traditional Name: N-(2-cyano-4-nitro-phenyl)-2,5-dimethyl-pyrazole-3-carboxamide Formula: C13H11N5O3 MolecularWeight: 285.25814

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)C(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])C#N)C

Isomeric SMILES

CC1=NN(C(=C1)C(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])C#N)C

InChI

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