| SpectraBase Spectrum ID |
EowPQTWKYQa |
| Name |
(1S*,2R*,4R*,5R*/S*)-1-Ethoxy-5-[N-(naphthalen-1'-ylmethyl)-3-(trifluoromethyl)benzenesulfonylamido]bicyclo[2.2.2]octane-2-carboxylic acid |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C29H30F3NO5S |
| InChI |
InChI=1S/C29H30F3NO5S/c1-2-38-28-14-13-24(20(17-28)15-19-9-5-8-18-7-3-4-12-23(18)19)26(25(28)27(34)35)33-39(36,37)22-11-6-10-21(16-22)29(30,31)32/h3-12,16,20,24-26,33H,2,13-15,17H2,1H3,(H,34,35)/t20?,24-,25-,26-,28-/m0/s1 |
| InChIKey |
YBJAOJMOZOALFE-UDAIQSNDSA-N |
| Molecular Weight |
561.616 g/mol |
| SMILES |
N([C@@]1([C@@](C(=O)O)([C@]2(CC([C@@]1(CC2)[H])Cc1c2c(cccc2)ccc1)OCC)[H])[H])S(c1cc(C(F)(F)F)ccc1)(=O)=O |
| SPLASH |
splash10-03di-0200090000-2e5835af7680169c4347 |
| Source of Spectrum |
KC-0-3652-52 |
| Synonyms |
(1S*,2R*,4R*,5R*/S*)-1-Ethoxy-5-[N-(naphthalen-1'-ylmethyl)-3'-(trifluoromethyl)benzylsulfonylamido]bicyclo[2.2.2]octane-2-carboxylic acid
(1S,2R,4R,5S)-1-ethoxy-5-(1-naphthylmethyl)-3-({[3-(trifluoromethyl)phenyl]sulfonyl}amino)bicyclo[2.2.2]octane-2-carboxylic acid |
| Wiley ID |
831902 |
![(1S*,2R*,4R*,5R*/S*)-1-Ethoxy-5-[N-(naphthalen-1'-ylmethyl)-3-(trifluoromethyl)benzenesulfonylamido]bicyclo[2.2.2]octane-2-carboxylic acid](/api/spectrum/EowPQTWKYQa/structure.png?h=300&w=458 "(1S*,2R*,4R*,5R*/S*)-1-Ethoxy-5-[N-(naphthalen-1'-ylmethyl)-3-(trifluoromethyl)benzenesulfonylamido]bicyclo[2.2.2]octane-2-carboxylic acid")
