ethyl 2-(4-chlorophenyl)-3-oxidanyl-2-(1,2,4-triazol-1-yl)propanoate

Systemtic Name: ethyl 2-(4-chlorophenyl)-3-oxidanyl-2-(1,2,4-triazol-1-yl)propanoate Openeye Name: ethyl 2-(4-chlorophenyl)-3-hydroxy-2-(1,2,4-triazol-1-yl)propanoate CAS Name: 2-(4-chlorophenyl)-3-hydroxy-2-(1,2,4-triazol-1-yl)propanoic acid ethyl ester IUPAC Name: ethyl 2-(4-chlorophenyl)-3-hydroxy-2-(1,2,4-triazol-1-yl)propanoate Traditional Name: 2-(4-chlorophenyl)-3-hydroxy-2-(1,2,4-triazol-1-yl)propionic acid ethyl ester Formula: C13H14ClN3O3 MolecularWeight: 295.72156

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CO)(C1=CC=C(C=C1)Cl)N2C=NC=N2

Isomeric SMILES

CCOC(=O)C(CO)(C1=CC=C(C=C1)Cl)N2C=NC=N2

InChI

InChI=1S/C13H14ClN3O3/c1-2-20-12(19)13(7-18,17-9-15-8-16-17)10-3-5-11(14)6-4-10/h3-6,8-9,18H,2,7H2,1H3