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

Systemtic Name: methyl 2-(3-chloranyl-1-methyl-5-oxidanylidene-1,2,4-triazol-4-yl)benzoate Openeye Name: methyl 2-(3-chloro-1-methyl-5-oxo-1,2,4-triazol-4-yl)benzoate CAS Name: 2-(3-chloro-1-methyl-5-oxo-1,2,4-triazol-4-yl)benzoic acid methyl ester IUPAC Name: methyl 2-(3-chloro-1-methyl-5-oxo-1,2,4-triazol-4-yl)benzoate Traditional Name: 2-(3-chloro-5-keto-1-methyl-1,2,4-triazol-4-yl)benzoic acid methyl ester Formula: C11H10ClN3O3 MolecularWeight: 267.6684

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)N(C(=N1)Cl)C2=CC=CC=C2C(=O)OC

Isomeric SMILES

CN1C(=O)N(C(=N1)Cl)C2=CC=CC=C2C(=O)OC

InChI

InChI=1S/C11H10ClN3O3/c1-14-11(17)15(10(12)13-14)8-6-4-3-5-7(8)9(16)18-2/h3-6H,1-2H3