| Properties | Image |
|---|
| MNX_ID | MNXM1172251 |
 |
| reference | envipathM:...4e9d902bbb94 |
| formula | C21H24N2O6 |
| global charge | 0 |
| mol weight | 400.431 |
| InChIKey | IUIWQDBBWFEZOR-UHFFFAOYSA-N |
| InChI | InChI=1S/C21H24N2O6/c24-9-1-2-11-28-20(26)22-18-7-3-5-16(14-18)13-17-6-4-8-19(15-17)23-21(27)29-12-10-25/h3-9,14-15,25H,1-2,10-13H2,(H,22,26)(H,23,27) |
| SMILES | O=CCCCOC(=O)NC1=CC(CC2=CC=CC(NC(=O)OCCO)=C2)=CC=C1 |
MNX internals
| InChI (mnx) | InChI=1/C21H24N2O6/c24-9-1-2-11-28-20(26)22-18-7-3-5-16(14-18)13-17-6-4-8-19(15-17)23-21(27)29-12-10-25/h3-9,14-15,25H,1-2,10-13H2,(H,22,26)(H,23,27) |
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| SMILES (mnx) | [CH2:1]([CH2:2][CH2:11][O:28][C:20](=[N:22][C:18]1=[CH:7][CH:3]=[CH:5][C:16]([CH2:13][C:17]2=[CH:15][C:19]([N:23]=[C:21]([OH:27])[O:29][CH2:12][CH2:10][OH:25])=[CH:8][CH:4]=[CH:6]2)=[CH:14]1)[OH:26])[CH:9]=[O:24] |
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