N-[4-cyano-1-(2,4-dinitrophenyl)pyrazol-3-yl]-4-methoxy-benzamide

Systemtic Name: N-[4-cyano-1-(2,4-dinitrophenyl)pyrazol-3-yl]-4-methoxy-benzamide Openeye Name: N-[4-cyano-1-(2,4-dinitrophenyl)pyrazol-3-yl]-4-methoxy-benzamide CAS Name: N-[4-cyano-1-(2,4-dinitrophenyl)-3-pyrazolyl]-4-methoxybenzamide IUPAC Name: N-[4-cyano-1-(2,4-dinitrophenyl)pyrazol-3-yl]-4-methoxybenzamide Traditional Name: N-[4-cyano-1-(2,4-dinitrophenyl)pyrazol-3-yl]-4-methoxy-benzamide Formula: C18H12N6O6 MolecularWeight: 408.32448

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)NC2=NN(C=C2C#N)C3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)NC2=NN(C=C2C#N)C3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C18H12N6O6/c1-30-14-5-2-11(3-6-14)18(25)20-17-12(9-19)10-22(21-17)15-7-4-13(23(26)27)8-16(15)24(28)29/h2-8,10H,1H3,(H,20,21,25)