2-[4-[2-Nitro-4-(trifluoromethyl)phenyl]-1-piperazinyl]ethyl 2-thiophenecarboxylate

CAS Registry Number®

338748-61-1
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CAS Name

2-[4-[2-Nitro-4-(trifluoromethyl)phenyl]-1-piperazinyl]ethyl 2-thiophenecarboxylate

Molecular Formula

C18H18F3N3O4S

Molecular Mass

429.41

Cite this Page

2-[4-[2-Nitro-4-(trifluoromethyl)phenyl]-1-piperazinyl]ethyl 2-thiophenecarboxylate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=338748-61-1 (retrieved 2024-08-26) (CAS RN: 338748-61-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C18H18F3N3O4S/c19-18(20,21)13-3-4-14(15(12-13)24(26)27)23-7-5-22(6-8-23)9-10-28-17(25)16-2-1-11-29-16/h1-4,11-12H,5-10H2

InChIKey

InChIKey=KTMCMHFYDKBORI-UHFFFAOYSA-N

SMILES

N(=O)(=O)C1=C(C=CC(C(F)(F)F)=C1)N2CCN(CCOC(=O)C3=CC=CS3)CC2

Canonical SMILES

O=C(OCCN1CCN(C2=CC=C(C=C2N(=O)=O)C(F)(F)F)CC1)C=3SC=CC3

Other Names for this Substance

  • 2-Thiophenecarboxylic acid, 2-[4-[2-nitro-4-(trifluoromethyl)phenyl]-1-piperazinyl]ethyl ester
  • 2-[4-[2-Nitro-4-(trifluoromethyl)phenyl]-1-piperazinyl]ethyl 2-thiophenecarboxylate