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

Systemtic Name: N-(2-cyano-4-nitro-phenyl)-3-(3-methoxy-4-nitro-pyrazol-1-yl)propanamide Openeye Name: N-(2-cyano-4-nitro-phenyl)-3-(3-methoxy-4-nitro-pyrazol-1-yl)propanamide CAS Name: N-(2-cyano-4-nitrophenyl)-3-(3-methoxy-4-nitro-1-pyrazolyl)propanamide IUPAC Name: N-(2-cyano-4-nitrophenyl)-3-(3-methoxy-4-nitropyrazol-1-yl)propanamide Traditional Name: N-(2-cyano-4-nitro-phenyl)-3-(3-methoxy-4-nitro-pyrazol-1-yl)propionamide Formula: C14H12N6O6 MolecularWeight: 360.28168

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NN(C=C1[N+](=O)[O-])CCC(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])C#N

Isomeric SMILES

COC1=NN(C=C1[N+](=O)[O-])CCC(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])C#N

InChI

InChI=1S/C14H12N6O6/c1-26-14-12(20(24)25)8-18(17-14)5-4-13(21)16-11-3-2-10(19(22)23)6-9(11)7-15/h2-3,6,8H,4-5H2,1H3,(H,16,21)