5-ethanoyl-2-[2,4,6-tris(chloranyl)phenyl]-1H-1,2,4-triazol-3-one

Systemtic Name: 5-ethanoyl-2-[2,4,6-tris(chloranyl)phenyl]-1H-1,2,4-triazol-3-one Openeye Name: 5-acetyl-2-(2,4,6-trichlorophenyl)-1H-1,2,4-triazol-3-one CAS Name: 5-acetyl-2-(2,4,6-trichlorophenyl)-1H-1,2,4-triazol-3-one IUPAC Name: 5-acetyl-2-(2,4,6-trichlorophenyl)-1H-1,2,4-triazol-3-one Traditional Name: 5-acetyl-2-(2,4,6-trichlorophenyl)-1H-1,2,4-triazol-3-one Formula: C10H6Cl3N3O2 MolecularWeight: 306.53254

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=NC(=O)N(N1)C2=C(C=C(C=C2Cl)Cl)Cl

Isomeric SMILES

CC(=O)C1=NC(=O)N(N1)C2=C(C=C(C=C2Cl)Cl)Cl

InChI

InChI=1S/C10H6Cl3N3O2/c1-4(17)9-14-10(18)16(15-9)8-6(12)2-5(11)3-7(8)13/h2-3H,1H3,(H,14,15,18)