| Properties | Image |
|---|
| MNX_ID | MNXM1190822 |
 |
| reference | envipathM:...ba78fde1c049 |
| formula | C23H24ClF3O6 |
| global charge | 0 |
| mol weight | 488.886 |
| InChIKey | UNVXMVSLJFYQHT-UHFFFAOYSA-N |
| InChI | InChI=1S/C23H24ClF3O6/c1-11-13(12-5-3-4-6-16(12)29)7-17(30)20(31)14(11)9-33-21(32)19-15(22(19,2)10-28)8-18(24)23(25,26)27/h3-7,15,18-19,28-31H,8-10H2,1-2H3 |
| SMILES | CC1=C(C2=C(O)C=CC=C2)C=C(O)C(O)=C1COC(=O)C1C(CC(Cl)C(F)(F)F)C1(C)CO |
MNX internals
| InChI (mnx) | InChI=1/C23H24ClF3O6/c1-11-13(12-5-3-4-6-16(12)29)7-17(30)20(31)14(11)9-33-21(32)19-15(22(19,2)10-28)8-18(24)23(25,26)27/h3-7,15,18-19,28-31H,8-10H2,1-2H3/t15?,18?,19?,22? |
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| SMILES (mnx) | [CH3:1][C:11]1=[C:14]([CH2:9][O:33][C:21]([CH:19]2[CH:15]([CH2:8][CH:18]([C:23]([F:25])([F:26])[F:27])[Cl:24])[C:22]2([CH3:2])[CH2:10][OH:28])=[O:32])[C:20]([OH:31])=[C:17]([OH:30])[CH:7]=[C:13]1[C:12]1=[CH:5][CH:3]=[CH:4][CH:6]=[C:16]1[OH:29] |
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