SpectraBase Spectrum ID |
GC6tjHcaUBO |
Name |
(S)-1-[4-(4-Methoxyphenylsulfonyl)piperazin-1-yl]-3-(3-nitrophenoxy)propan-2-ol hydrochloride |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C20H26ClN3O7S |
InChI |
InChI=1S/C20H25N3O7S.ClH/c1-29-18-5-7-20(8-6-18)31(27,28)22-11-9-21(10-12-22)14-17(24)15-30-19-4-2-3-16(13-19)23(25)26;/h2-8,13,17,24H,9-12,14-15H2,1H3;1H/t17-;/m0./s1 |
InChIKey |
CEFOPYMXFWMSDM-LMOVPXPDSA-N |
Molecular Weight |
487.955 g/mol |
SMILES |
Cl.O[C@@](CN1CCN(CC1)S(=O)(=O)c1ccc(cc1)OC)(COc1cc(ccc1)[N+](=O)[O-])[H] |
SPLASH |
splash10-03e9-0191000000-6d192891b5651b81b90e |
Source of Spectrum |
CMC-4-2094-23' |
Synonyms |
(S)-1-(4-((4-methoxyphenyl)sulfonyl)piperazin-1-yl)-3-(3-nitrophenoxy)propan-2-ol hydrochloride |
Wiley ID |
1771558 |