1H-Benzimidazolium, 1-methyl-3-[2-[[(1R,2S,5R)-5-methyl-2-(1-methylethyl)cyclohexyl]oxy]-2-oxoethyl]-2-[3-(trifluoromethyl)phenyl]-, iodide (1:1)
CAS Registry Number®
2101317-21-7
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CAS Name
1H-Benzimidazolium, 1-methyl-3-[2-[[(1R,2S,5R)-5-methyl-2-(1-methylethyl)cyclohexyl]oxy]-2-oxoethyl]-2-[3-(trifluoromethyl)phenyl]-, iodide (1:1)Molecular Formula
C27H32F3N2O2.ICite this Page
1H-Benzimidazolium, 1-methyl-3-[2-[[(1R,2S,5R)-5-methyl-2-(1-methylethyl)cyclohexyl]oxy]-2-oxoethyl]-2-[3-(trifluoromethyl)phenyl]-, iodide (1:1). CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=2101317-21-7 (retrieved ) (CAS RN: 2101317-21-7). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C27H32F3N2O2.HI/c1-17(2)21-13-12-18(3)14-24(21)34-25(33)16-32-23-11-6-5-10-22(23)31(4)26(32)19-8-7-9-20(15-19)27(28,29)30;/h5-11,15,17-18,21,24H,12-14,16H2,1-4H3;1H/q+1;/p-1/t18-,21+,24-;/m1./s1
InChIKey
InChIKey=DCAJNAWCJSUZDG-DZJKTSMVSA-M
SMILES
C(C(O[C@H]1[C@H](C(C)C)CC[C@@H](C)C1)=O)[N+]2=C(N(C)C=3C2=CC=CC3)C4=CC(C(F)(F)F)=CC=C4.[I-]
Canonical SMILES
[I-].O=C(OC1CC(C)CCC1C(C)C)C[N+]=2C=3C=CC=CC3N(C2C=4C=CC=C(C4)C(F)(F)F)C
Other Names for this Substance
- 1H-Benzimidazolium, 1-methyl-3-[2-[[(1R,2S,5R)-5-methyl-2-(1-methylethyl)cyclohexyl]oxy]-2-oxoethyl]-2-[3-(trifluoromethyl)phenyl]-, iodide (1:1)
- S-Gboxin