Ethyl 4-[4-(1,1-dimethylethyl)phenyl]-4,5-dihydro-3-methyl-5-oxo-1H-1,2,4-triazole-1-acetate

CAS Registry Number®

860612-53-9
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CAS Name

Ethyl 4-[4-(1,1-dimethylethyl)phenyl]-4,5-dihydro-3-methyl-5-oxo-1H-1,2,4-triazole-1-acetate

Molecular Formula

C17H23N3O3

Molecular Mass

317.38

Cite this Page

Ethyl 4-[4-(1,1-dimethylethyl)phenyl]-4,5-dihydro-3-methyl-5-oxo-1H-1,2,4-triazole-1-acetate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=860612-53-9 (retrieved 2024-08-24) (CAS RN: 860612-53-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C17H23N3O3/c1-6-23-15(21)11-19-16(22)20(12(2)18-19)14-9-7-13(8-10-14)17(3,4)5/h7-10H,6,11H2,1-5H3

InChIKey

InChIKey=SCEJZQBPMAYKEW-UHFFFAOYSA-N

SMILES

O=C1N(C(C)=NN1CC(OCC)=O)C2=CC=C(C(C)(C)C)C=C2

Canonical SMILES

O=C(OCC)CN1N=C(N(C1=O)C2=CC=C(C=C2)C(C)(C)C)C

Other Names for this Substance

  • 1H-1,2,4-Triazole-1-acetic acid, 4-[4-(1,1-dimethylethyl)phenyl]-4,5-dihydro-3-methyl-5-oxo-, ethyl ester
  • Ethyl 4-[4-(1,1-dimethylethyl)phenyl]-4,5-dihydro-3-methyl-5-oxo-1H-1,2,4-triazole-1-acetate