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

Systemtic Name: methyl 2-chloranyl-4-methyl-5-(5-methyl-3-oxidanylidene-1H-1,2,4-triazol-2-yl)benzoate Openeye Name: methyl 2-chloro-4-methyl-5-(5-methyl-3-oxo-1H-1,2,4-triazol-2-yl)benzoate CAS Name: 2-chloro-4-methyl-5-(5-methyl-3-oxo-1H-1,2,4-triazol-2-yl)benzoic acid methyl ester IUPAC Name: methyl 2-chloro-4-methyl-5-(5-methyl-3-oxo-1H-1,2,4-triazol-2-yl)benzoate Traditional Name: 2-chloro-5-(3-keto-5-methyl-1H-1,2,4-triazol-2-yl)-4-methyl-benzoic acid methyl ester Formula: C12H12ClN3O3 MolecularWeight: 281.69498

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C(=C1)Cl)C(=O)OC)N2C(=O)N=C(N2)C

Isomeric SMILES

CC1=C(C=C(C(=C1)Cl)C(=O)OC)N2C(=O)N=C(N2)C

InChI

InChI=1S/C12H12ClN3O3/c1-6-4-9(13)8(11(17)19-3)5-10(6)16-12(18)14-7(2)15-16/h4-5H,1-3H3,(H,14,15,18)