2-methyl-4-(4-nitrophenyl)-5-phenyl-1,2,4-triazol-3-one

Systemtic Name: 2-methyl-4-(4-nitrophenyl)-5-phenyl-1,2,4-triazol-3-one Openeye Name: 2-methyl-4-(4-nitrophenyl)-5-phenyl-1,2,4-triazol-3-one CAS Name: 2-methyl-4-(4-nitrophenyl)-5-phenyl-1,2,4-triazol-3-one IUPAC Name: 2-methyl-4-(4-nitrophenyl)-5-phenyl-1,2,4-triazol-3-one Traditional Name: 2-methyl-4-(4-nitrophenyl)-5-phenyl-1,2,4-triazol-3-one Formula: C15H12N4O3 MolecularWeight: 296.28078

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)N(C(=N1)C2=CC=CC=C2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CN1C(=O)N(C(=N1)C2=CC=CC=C2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

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