SpectraBase Spectrum ID |
KvCPsfFKoKZ |
Name |
(2S,8S)-2-[2'-(4'',4''-Diethoxybutyl)-N-(nosylamino)but-3'-enyl]-N'-nosyl-1,2,5,6-tetrahydropyridine |
Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C29H38N4O10S2 |
InChI |
InChI=1S/C29H38N4O10S2/c1-4-23(22-24-14-11-12-20-31(24)45(40,41)28-18-10-8-16-26(28)33(36)37)30(21-13-19-29(42-5-2)43-6-3)44(38,39)27-17-9-7-15-25(27)32(34)35/h4,7-11,14-18,23-24,29H,1,5-6,12-13,19-22H2,2-3H3/t23-,24+/m0/s1 |
InChIKey |
SWGPGDDYLZSBRE-BJKOFHAPSA-N |
Molecular Weight |
666.761 g/mol |
SMILES |
c1(S(N2[C@@](C[C@@](N(S(c3c(N(=O)=O)cccc3)(=O)=O)CCCC(OCC)OCC)(C=C)[H])(C=CCC2)[H])(=O)=O)c(N(=O)=O)cccc1 |
SPLASH |
splash10-014i-0390000000-b34070e1fc4730d19c41 |
Source of Spectrum |
C-122-9589-16 |
Synonyms |
N-(4,4-diethoxybutyl)-2-nitro-N-[(2R)-1-[(6S)-1-(2-nitrophenyl)sulfonyl-3,6-dihydro-2H-pyridin-6-yl]but-3-en-2-yl]benzenesulfonamide |
Wiley ID |
1700462 |