N-(2-cyano-4-nitro-phenyl)-3-(3,5-dimethyl-4-nitro-pyrazol-1-yl)propanamide

Systemtic Name: N-(2-cyano-4-nitro-phenyl)-3-(3,5-dimethyl-4-nitro-pyrazol-1-yl)propanamide Openeye Name: N-(2-cyano-4-nitro-phenyl)-3-(3,5-dimethyl-4-nitro-pyrazol-1-yl)propanamide CAS Name: N-(2-cyano-4-nitrophenyl)-3-(3,5-dimethyl-4-nitro-1-pyrazolyl)propanamide IUPAC Name: N-(2-cyano-4-nitrophenyl)-3-(3,5-dimethyl-4-nitropyrazol-1-yl)propanamide Traditional Name: N-(2-cyano-4-nitro-phenyl)-3-(3,5-dimethyl-4-nitro-pyrazol-1-yl)propionamide Formula: C15H14N6O5 MolecularWeight: 358.30886

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CCC(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])C#N)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CCC(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])C#N)C)[N+](=O)[O-]

InChI

InChI=1S/C15H14N6O5/c1-9-15(21(25)26)10(2)19(18-9)6-5-14(22)17-13-4-3-12(20(23)24)7-11(13)8-16/h3-4,7H,5-6H2,1-2H3,(H,17,22)