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

Systemtic Name: N-(2-cyano-4-nitro-phenyl)-3-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-2-methyl-propanamide Openeye Name: N-(2-cyano-4-nitro-phenyl)-3-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-2-methyl-propanamide CAS Name: N-(2-cyano-4-nitrophenyl)-3-(3,5-dimethyl-4-nitro-1-pyrazolyl)-2-methylpropanamide IUPAC Name: N-(2-cyano-4-nitrophenyl)-3-(3,5-dimethyl-4-nitropyrazol-1-yl)-2-methylpropanamide Traditional Name: N-(2-cyano-4-nitro-phenyl)-3-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-2-methyl-propionamide Formula: C16H16N6O5 MolecularWeight: 372.33544

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(C)C(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])C#N)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC(C)C(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])C#N)C)[N+](=O)[O-]

InChI

InChI=1S/C16H16N6O5/c1-9(8-20-11(3)15(22(26)27)10(2)19-20)16(23)18-14-5-4-13(21(24)25)6-12(14)7-17/h4-6,9H,8H2,1-3H3,(H,18,23)