| Properties | Image |
|---|
| MNX_ID | MNXM1182982 |
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| reference | envipathM:...4e219e3ff202 |
| formula | C15H15F17N2O5S |
| global charge | 0 |
| mol weight | 658.327 |
| InChIKey | LPOBUHMFSOWWQA-UHFFFAOYSA-N |
| InChI | InChI=1S/C15H15F17N2O5S/c1-34(2,5-7(36)37)4-3-6(35)33-40(38,39)15(31,32)13(26,27)11(22,23)9(18,19)8(16,17)10(20,21)12(24,25)14(28,29)30/h6,33,35H,3-5H2,1-2H3 |
| SMILES | C[N+](C)(CCC(O)NS(=O)(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)CC(=O)[O-] |
MNX internals
| InChI (mnx) | InChI=1/C15H15F17N2O5S/c1-34(2,5-7(36)37)4-3-6(35)33-40(38,39)15(31,32)13(26,27)11(22,23)9(18,19)8(16,17)10(20,21)12(24,25)14(28,29)30/h6,33,35H,3-5H2,1-2H3/t6? |
 |
| SMILES (mnx) | [CH3:1][N+:34]([CH3:2])([CH2:4][CH2:3][CH:6]([NH:33][S:40]([C:15]([C:13]([C:11]([C:9]([C:8]([C:10]([C:12]([C:14]([F:28])([F:29])[F:30])([F:24])[F:25])([F:20])[F:21])([F:16])[F:17])([F:18])[F:19])([F:22])[F:23])([F:26])[F:27])([F:31])[F:32])(=[O:38])=[O:39])[OH:35])[CH2:5][C:7](=[O:36])[O-:37] |
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