2-(2,4-dinitrophenyl)-4-(4-methylphenyl)-1,2,4-triazol-3-one

Systemtic Name: 2-(2,4-dinitrophenyl)-4-(4-methylphenyl)-1,2,4-triazol-3-one Openeye Name: 2-(2,4-dinitrophenyl)-4-(p-tolyl)-1,2,4-triazol-3-one CAS Name: 2-(2,4-dinitrophenyl)-4-(4-methylphenyl)-1,2,4-triazol-3-one IUPAC Name: 2-(2,4-dinitrophenyl)-4-(4-methylphenyl)-1,2,4-triazol-3-one Traditional Name: 2-(2,4-dinitrophenyl)-4-(p-tolyl)-1,2,4-triazol-3-one Formula: C15H11N5O5 MolecularWeight: 341.27834

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C=NN(C2=O)C3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)N2C=NN(C2=O)C3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C15H11N5O5/c1-10-2-4-11(5-3-10)17-9-16-18(15(17)21)13-7-6-12(19(22)23)8-14(13)20(24)25/h2-9H,1H3