Benzoic acid, 4-[(4-ethyl-1-piperazinyl)methyl]-3-(trifluoromethyl)-, methyl ester

CAS Registry Number®

896160-79-5
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CAS Name

Benzoic acid, 4-[(4-ethyl-1-piperazinyl)methyl]-3-(trifluoromethyl)-, methyl ester

Molecular Formula

C16H21F3N2O2

Molecular Mass

330.35

Cite this Page

Benzoic acid, 4-[(4-ethyl-1-piperazinyl)methyl]-3-(trifluoromethyl)-, methyl ester.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=896160-79-5 (retrieved 2024-07-08) (CAS RN: 896160-79-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C16H21F3N2O2/c1-3-20-6-8-21(9-7-20)11-13-5-4-12(15(22)23-2)10-14(13)16(17,18)19/h4-5,10H,3,6-9,11H2,1-2H3

InChIKey

InChIKey=WUYNBCXKUJGCFU-UHFFFAOYSA-N

SMILES

C(F)(F)(F)C1=C(CN2CCN(CC)CC2)C=CC(C(OC)=O)=C1

Canonical SMILES

O=C(OC)C1=CC=C(C(=C1)C(F)(F)F)CN2CCN(CC)CC2

Other Names for this Substance

  • Benzoic acid, 4-[(4-ethyl-1-piperazinyl)methyl]-3-(trifluoromethyl)-, methyl ester
  • Methyl 4-[(4-ethylpiperazin-1-yl)methyl]-3-(trifluoromethyl)benzoate