| Properties | Image |
|---|
| MNX_ID | MNXM1192604 |
 |
| reference | envipathM:...1c3e59f98071 |
| formula | C23H24ClF3O5 |
| global charge | 0 |
| mol weight | 472.887 |
| InChIKey | VYEROUFFOLCZFI-UHFFFAOYSA-N |
| InChI | InChI=1S/C23H24ClF3O5/c1-11-12(5-4-6-13(11)14-7-8-16(28)20(30)19(14)29)10-32-21(31)18-15(22(18,2)3)9-17(24)23(25,26)27/h4-8,15,17-18,28-30H,9-10H2,1-3H3 |
| SMILES | CC1=C(COC(=O)C2C(CC(Cl)C(F)(F)F)C2(C)C)C=CC=C1C1=C(O)C(O)=C(O)C=C1 |
MNX internals
| InChI (mnx) | InChI=1/C23H24ClF3O5/c1-11-12(5-4-6-13(11)14-7-8-16(28)20(30)19(14)29)10-32-21(31)18-15(22(18,2)3)9-17(24)23(25,26)27/h4-8,15,17-18,28-30H,9-10H2,1-3H3/t15?,17?,18? |
 |
| SMILES (mnx) | [CH3:1][C:11]1=[C:12]([CH2:10][O:32][C:21]([CH:18]2[CH:15]([CH2:9][CH:17]([C:23]([F:25])([F:26])[F:27])[Cl:24])[C:22]2([CH3:2])[CH3:3])=[O:31])[CH:5]=[CH:4][CH:6]=[C:13]1[C:14]1=[C:19]([OH:29])[C:20]([OH:30])=[C:16]([OH:28])[CH:8]=[CH:7]1 |
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