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

Systemtic Name: N-(2-cyano-4-nitro-phenyl)-3-(5-methyl-3-nitro-pyrazol-1-yl)propanamide Openeye Name: N-(2-cyano-4-nitro-phenyl)-3-(5-methyl-3-nitro-pyrazol-1-yl)propanamide CAS Name: N-(2-cyano-4-nitrophenyl)-3-(5-methyl-3-nitro-1-pyrazolyl)propanamide IUPAC Name: N-(2-cyano-4-nitrophenyl)-3-(5-methyl-3-nitropyrazol-1-yl)propanamide Traditional Name: N-(2-cyano-4-nitro-phenyl)-3-(5-methyl-3-nitro-pyrazol-1-yl)propionamide Formula: C14H12N6O5 MolecularWeight: 344.28228

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H12N6O5/c1-9-6-13(20(24)25)17-18(9)5-4-14(21)16-12-3-2-11(19(22)23)7-10(12)8-15/h2-3,6-7H,4-5H2,1H3,(H,16,21)