(phenylmethyl) 2-chloranyl-5-(3-chloranyl-1-methyl-5-oxidanylidene-1,2,4-triazol-4-yl)-4-fluoranyl-benzoate

Systemtic Name: (phenylmethyl) 2-chloranyl-5-(3-chloranyl-1-methyl-5-oxidanylidene-1,2,4-triazol-4-yl)-4-fluoranyl-benzoate Openeye Name: benzyl 2-chloro-5-(3-chloro-1-methyl-5-oxo-1,2,4-triazol-4-yl)-4-fluoro-benzoate CAS Name: 2-chloro-5-(3-chloro-1-methyl-5-oxo-1,2,4-triazol-4-yl)-4-fluorobenzoic acid (phenylmethyl) ester IUPAC Name: benzyl 2-chloro-5-(3-chloro-1-methyl-5-oxo-1,2,4-triazol-4-yl)-4-fluorobenzoate Traditional Name: 2-chloro-5-(3-chloro-5-keto-1-methyl-1,2,4-triazol-4-yl)-4-fluoro-benzoic acid benzyl ester Formula: C17H12Cl2FN3O3 MolecularWeight: 396.199883

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)N(C(=N1)Cl)C2=C(C=C(C(=C2)C(=O)OCC3=CC=CC=C3)Cl)F

Isomeric SMILES

CN1C(=O)N(C(=N1)Cl)C2=C(C=C(C(=C2)C(=O)OCC3=CC=CC=C3)Cl)F

InChI

InChI=1S/C17H12Cl2FN3O3/c1-22-17(25)23(16(19)21-22)14-7-11(12(18)8-13(14)20)15(24)26-9-10-5-3-2-4-6-10/h2-8H,9H2,1H3