4-[1-(2,4-dinitrophenyl)-5-methyl-1,2,4-triazol-3-yl]benzenecarbonitrile

Systemtic Name: 4-[1-(2,4-dinitrophenyl)-5-methyl-1,2,4-triazol-3-yl]benzenecarbonitrile Openeye Name: 4-[1-(2,4-dinitrophenyl)-5-methyl-1,2,4-triazol-3-yl]benzonitrile CAS Name: 4-[1-(2,4-dinitrophenyl)-5-methyl-1,2,4-triazol-3-yl]benzonitrile IUPAC Name: 4-[1-(2,4-dinitrophenyl)-5-methyl-1,2,4-triazol-3-yl]benzonitrile Traditional Name: 4-[1-(2,4-dinitrophenyl)-5-methyl-1,2,4-triazol-3-yl]benzonitrile Formula: C16H10N6O4 MolecularWeight: 350.2884

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NN1C2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])C3=CC=C(C=C3)C#N

Isomeric SMILES

CC1=NC(=NN1C2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])C3=CC=C(C=C3)C#N

InChI

InChI=1S/C16H10N6O4/c1-10-18-16(12-4-2-11(9-17)3-5-12)19-20(10)14-7-6-13(21(23)24)8-15(14)22(25)26/h2-8H,1H3