SpectraBase Spectrum ID |
41OisfxjG6y |
Name |
N-((1R*,5R*,8R*)-8-Chloro-5-((4-chlorophenyl)ethynyl)-7-hexylbicyclo[3.2.1]oct-6-en-6-yl)-4-methylbenzenesulfonamide |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C29H33Cl2NO2S |
InChI |
InChI=1S/C29H33Cl2NO2S/c1-3-4-5-6-8-26-25-9-7-19-29(27(25)31,20-18-22-12-14-23(30)15-13-22)28(26)32-35(33,34)24-16-10-21(2)11-17-24/h10-17,25,27,32H,3-9,19H2,1-2H3/t25-,27+,29+/m1/s1 |
InChIKey |
DLVNHCKIXKJATH-WBJKNQCFSA-N |
Molecular Weight |
530.554 g/mol |
SMILES |
N(C1=C([C@@]2([C@@]([C@]1(CCC2)C#Cc1ccc(cc1)Cl)(Cl)[H])[H])CCCCCC)S(c1ccc(cc1)C)(=O)=O |
SPLASH |
splash10-0aw9-1179000000-625ceafe1b3fbd5c1d63 |
Source of Spectrum |
ASC-361-SM39-2n |
Synonyms |
N-((1R,5R,8R)-8-chloro-5-((4-chlorophenyl)ethynyl)-7-hexylbicyclo[3.2.1]oct-6-en-6-yl)-4-methylbenzenesulfonamide |
Wiley ID |
1813975 |