Ethyl 1-[2-(4-chlorophenyl)-2-oxoethyl]-1H-1,2,4-triazole-3-carboxylate

CAS Registry Number®

1638612-68-6
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CAS Name

Ethyl 1-[2-(4-chlorophenyl)-2-oxoethyl]-1H-1,2,4-triazole-3-carboxylate

Molecular Formula

C13H12ClN3O3

Molecular Mass

293.71

Cite this Page

Ethyl 1-[2-(4-chlorophenyl)-2-oxoethyl]-1H-1,2,4-triazole-3-carboxylate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1638612-68-6 (retrieved 2024-09-10) (CAS RN: 1638612-68-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C13H12ClN3O3/c1-2-20-13(19)12-15-8-17(16-12)7-11(18)9-3-5-10(14)6-4-9/h3-6,8H,2,7H2,1H3

InChIKey

InChIKey=CWVZCLONOZHJRI-UHFFFAOYSA-N

SMILES

C(C(=O)C1=CC=C(Cl)C=C1)N2N=C(C(OCC)=O)N=C2

Canonical SMILES

O=C(OCC)C=1N=CN(N1)CC(=O)C2=CC=C(Cl)C=C2

Other Names for this Substance

  • 1H-1,2,4-Triazole-3-carboxylic acid, 1-[2-(4-chlorophenyl)-2-oxoethyl]-, ethyl ester
  • Ethyl 1-[2-(4-chlorophenyl)-2-oxoethyl]-1H-1,2,4-triazole-3-carboxylate