Benzoic acid, 2-[[7-(trifluoromethyl)-4-quinolinyl]amino]-, 2-[4-[3-(trifluoromethyl)phenyl]-1-piperazinyl]ethyl ester, hydrochloride (1:2)
CAS Registry Number®
55300-30-6
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CAS Name
Benzoic acid, 2-[[7-(trifluoromethyl)-4-quinolinyl]amino]-, 2-[4-[3-(trifluoromethyl)phenyl]-1-piperazinyl]ethyl ester, hydrochloride (1:2)Molecular Formula
C30H26F6N4O2.2ClHCite this Page
Benzoic acid, 2-[[7-(trifluoromethyl)-4-quinolinyl]amino]-, 2-[4-[3-(trifluoromethyl)phenyl]-1-piperazinyl]ethyl ester, hydrochloride (1:2). CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=55300-30-6 (retrieved ) (CAS RN: 55300-30-6). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C30H26F6N4O2.2ClH/c31-29(32,33)20-4-3-5-22(18-20)40-14-12-39(13-15-40)16-17-42-28(41)24-6-1-2-7-25(24)38-26-10-11-37-27-19-21(30(34,35)36)8-9-23(26)27;;/h1-11,18-19H,12-17H2,(H,37,38);2*1H
InChIKey
InChIKey=GEZLWXYIFNEJBC-UHFFFAOYSA-N
SMILES
N(C=1C2=C(C=C(C(F)(F)F)C=C2)N=CC1)C3=C(C(OCCN4CCN(CC4)C5=CC(C(F)(F)F)=CC=C5)=O)C=CC=C3.Cl
Canonical SMILES
Cl.O=C(OCCN1CCN(C2=CC=CC(=C2)C(F)(F)F)CC1)C=3C=CC=CC3NC=4C=CN=C5C=C(C=CC54)C(F)(F)F
Other Names for this Substance
- Benzoic acid, 2-[[7-(trifluoromethyl)-4-quinolinyl]amino]-, 2-[4-[3-(trifluoromethyl)phenyl]-1-piperazinyl]ethyl ester, hydrochloride (1:2)
- Benzoic acid, 2-[[7-(trifluoromethyl)-4-quinolinyl]amino]-, 2-[4-[3-(trifluoromethyl)phenyl]-1-piperazinyl]ethyl ester, dihydrochloride
Deleted or Replaced CAS Registry Numbers
56211-42-8
