[2-(4-chlorophenyl)-2-oxidanylidene-ethyl] 2-methyl-2-(1,2,4-triazol-1-yl)propanoate

Systemtic Name: [2-(4-chlorophenyl)-2-oxidanylidene-ethyl] 2-methyl-2-(1,2,4-triazol-1-yl)propanoate Openeye Name: [2-(4-chlorophenyl)-2-oxo-ethyl] 2-methyl-2-(1,2,4-triazol-1-yl)propanoate CAS Name: 2-methyl-2-(1,2,4-triazol-1-yl)propanoic acid [2-(4-chlorophenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-chlorophenyl)-2-oxoethyl] 2-methyl-2-(1,2,4-triazol-1-yl)propanoate Traditional Name: 2-methyl-2-(1,2,4-triazol-1-yl)propionic acid [2-(4-chlorophenyl)-2-keto-ethyl] ester Formula: C14H14ClN3O3 MolecularWeight: 307.73226

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)OCC(=O)C1=CC=C(C=C1)Cl)N2C=NC=N2

Isomeric SMILES

CC(C)(C(=O)OCC(=O)C1=CC=C(C=C1)Cl)N2C=NC=N2

InChI

InChI=1S/C14H14ClN3O3/c1-14(2,18-9-16-8-17-18)13(20)21-7-12(19)10-3-5-11(15)6-4-10/h3-6,8-9H,7H2,1-2H3