| Properties | Image |
|---|
| MNX_ID | MNXM1170054 |
 |
| reference | envipathM:...d47b82b715d0 |
| formula | C10H7F13NO6S |
| global charge | -1 |
| mol weight | 516.208 |
| InChIKey | FAURWYGMLDFGDR-UHFFFAOYSA-M |
| InChI | InChI=1S/C10H8F13NO6S/c1-2(25)24(3(26)4(27)28)31(29,30)10(22,23)8(17,18)6(13,14)5(11,12)7(15,16)9(19,20)21/h2-3,25-26H,1H3,(H,27,28)/p-1 |
| SMILES | CC(O)N(C(O)C(=O)[O-])S(=O)(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F |
MNX internals
| InChI (mnx) | InChI=1/C10H8F13NO6S/c1-2(25)24(3(26)4(27)28)31(29,30)10(22,23)8(17,18)6(13,14)5(11,12)7(15,16)9(19,20)21/h2-3,25-26H,1H3,(H,27,28)/t2?,3? |
 |
| SMILES (mnx) | [CH3:1][CH:2]([N:24]([CH:3]([C:4](=[O:27])[OH:28])[OH:26])[S:31]([C:10]([C:8]([C:6]([C:5]([C:7]([C:9]([F:19])([F:20])[F:21])([F:15])[F:16])([F:11])[F:12])([F:13])[F:14])([F:17])[F:18])([F:22])[F:23])(=[O:29])=[O:30])[OH:25] |
|