3-ethanoyl-1-(4-nitrophenyl)-5-phenyl-1,2,4-triazin-6-one

Systemtic Name: 3-ethanoyl-1-(4-nitrophenyl)-5-phenyl-1,2,4-triazin-6-one Openeye Name: 3-acetyl-1-(4-nitrophenyl)-5-phenyl-1,2,4-triazin-6-one CAS Name: 3-acetyl-1-(4-nitrophenyl)-5-phenyl-1,2,4-triazin-6-one IUPAC Name: 3-acetyl-1-(4-nitrophenyl)-5-phenyl-1,2,4-triazin-6-one Traditional Name: 3-acetyl-1-(4-nitrophenyl)-5-phenyl-1,2,4-triazin-6-one Formula: C17H12N4O4 MolecularWeight: 336.30158

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=NN(C(=O)C(=N1)C2=CC=CC=C2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC(=O)C1=NN(C(=O)C(=N1)C2=CC=CC=C2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H12N4O4/c1-11(22)16-18-15(12-5-3-2-4-6-12)17(23)20(19-16)13-7-9-14(10-8-13)21(24)25/h2-10H,1H3