SpectraBase Spectrum ID |
5eJ8N1JoPUs |
Name |
(3S,3aS,9bS)-8-Bromo-1,3-diphenyl-2,3,3a,9b-tetrahydro-1H-5-oxa-4-thia-1-aza-cyclopenta[a]naphthalene 4,4-dioxide |
Alternate Name(s) |
8-Bromo-1,3-diphenyl-1,3,3a,9b-tetrahydrobenzo[e][1,2]-oxathiino[4,3-c]isoxazole-4,4-dioxide |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C21H16BrNO4S |
InChI |
InChI=1S/C21H16BrNO4S/c22-15-11-12-18-17(13-15)19-21(28(24,25)27-18)20(14-7-3-1-4-8-14)26-23(19)16-9-5-2-6-10-16/h1-13,19-21H/t19-,20+,21+/m0/s1 |
InChIKey |
ZCLRTLHUDILGFT-PWRODBHTSA-N |
Molecular Weight |
458.326 g/mol |
SMILES |
[C@@]12(S(Oc3ccc(cc3[C@@]2(N(c2ccccc2)O[C@@]1(c1ccccc1)[H])[H])Br)(=O)=O)[H] |
SPLASH |
splash10-052g-9700300000-d146f8652c1856421000 |
Source of Spectrum |
F-68-3646-3j |
Wiley ID |
1708526 |