3-(3,5-dinitrophenyl)-5-(4-methylphenyl)-1H-1,2,4-triazole

Systemtic Name: 3-(3,5-dinitrophenyl)-5-(4-methylphenyl)-1H-1,2,4-triazole Openeye Name: 3-(3,5-dinitrophenyl)-5-(p-tolyl)-1H-1,2,4-triazole CAS Name: 3-(3,5-dinitrophenyl)-5-(4-methylphenyl)-1H-1,2,4-triazole IUPAC Name: 3-(3,5-dinitrophenyl)-5-(4-methylphenyl)-1H-1,2,4-triazole Traditional Name: 3-(3,5-dinitrophenyl)-5-(p-tolyl)-1H-1,2,4-triazole Formula: C15H11N5O4 MolecularWeight: 325.27894

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=NN2)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=NN2)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C15H11N5O4/c1-9-2-4-10(5-3-9)14-16-15(18-17-14)11-6-12(19(21)22)8-13(7-11)20(23)24/h2-8H,1H3,(H,16,17,18)