5-(4-methylphenyl)-3-(2-nitrophenyl)-2H-1,2,3-triazol-4-one

Systemtic Name: 5-(4-methylphenyl)-3-(2-nitrophenyl)-2H-1,2,3-triazol-4-one Openeye Name: 3-(2-nitrophenyl)-5-(p-tolyl)-2H-triazol-4-one CAS Name: 5-(4-methylphenyl)-3-(2-nitrophenyl)-2H-triazol-4-one IUPAC Name: 5-(4-methylphenyl)-3-(2-nitrophenyl)-2H-triazol-4-one Traditional Name: 3-(2-nitrophenyl)-5-(p-tolyl)-2H-triazol-4-one Formula: C15H12N4O3 MolecularWeight: 296.28078

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H12N4O3/c1-10-6-8-11(9-7-10)14-15(20)18(17-16-14)12-4-2-3-5-13(12)19(21)22/h2-9,17H,1H3