| Properties | Image |
| MNX_ID | MNXM48253 |
 |
| reference | chebi:81863 |
| formula | C20H20FNO4 |
| global charge | 0 |
| mol weight | 357.381 |
| InChIKey | TYIYMOAHACZAMQ-CQSZACIVSA-N |
| InChI | InChI=1S/C20H20FNO4/c1-3-4-11-24-20(23)14(2)25-16-6-8-17(9-7-16)26-19-10-5-15(13-22)12-18(19)21/h5-10,12,14H,3-4,11H2,1-2H3/t14-/m1/s1 |
| SMILES | CCCCOC(=O)[C@@H](C)OC1=CC=C(OC2=CC=C(C#N)C=C2F)C=C1 |
MNX internals
| InChI (mnx) | InChI=1/C20H20FNO4/c1-3-4-11-24-20(23)14(2)25-16-6-8-17(9-7-16)26-19-10-5-15(13-22)12-18(19)21/h5-10,12,14H,3-4,11H2,1-2H3/t14-/m1/s1 |
 |
| SMILES (mnx) | [CH3:1][CH2:3][CH2:4][CH2:11][O:24][C:20]([C@@H:14]([CH3:2])[O:25][C:16]1=[CH:7][CH:9]=[C:17]([O:26][C:19]2=[C:18]([F:21])[CH:12]=[C:15]([C:13]#[N:22])[CH:5]=[CH:10]2)[CH:8]=[CH:6]1)=[O:23] |
|