| SpectraBase Spectrum ID |
LhOw3N79pWm |
| Name |
(2S,7R)-{2-[2'-(4",4"-Diethoxybutyl)-N-(nosylamino)but-3'-enyl}-N-nosyl-2,5-dihydropyrrole |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C28H36N4O10S2 |
| InChI |
InChI=1S/C28H36N4O10S2/c1-4-22(21-23-13-11-19-30(23)44(39,40)27-17-10-8-15-25(27)32(35)36)29(20-12-18-28(41-5-2)42-6-3)43(37,38)26-16-9-7-14-24(26)31(33)34/h4,7-11,13-17,22-23,28H,1,5-6,12,18-21H2,2-3H3/t22-,23+/m0/s1 |
| InChIKey |
XHAXLXMFDJEVSQ-XZOQPEGZSA-N |
| Molecular Weight |
652.734 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=CC2)[H])(=O)=O)c(N(=O)=O)cccc1 |
| SPLASH |
splash10-0uki-5890300000-89473df37ad55d332bcd |
| Source of Spectrum |
C-122-9589-20 |
| Synonyms |
N-(4,4-diethoxybutyl)-2-nitro-N-[(1R)-1-[[(2S)-1-(2-nitrophenyl)sulfonyl-2,5-dihydropyrrol-2-yl]methyl]allyl]benzenesulfonamide
N-(4,4-diethoxybutyl)-2-nitro-N-[(2R)-1-[(2S)-1-(2-nitrophenyl)sulfonyl-2,5-dihydropyrrol-2-yl]but-3-en-2-yl]benzenesulfonamide |
| Wiley ID |
1700460 |
