| Properties | Image |
|---|
| MNX_ID | MNXM1187919 |
 |
| reference | envipathM:...b9134af8d7cf |
| formula | C21H22ClN3O4 |
| global charge | 0 |
| mol weight | 415.877 |
| InChIKey | MFMBZAKNGJUQPL-JYPYDPOKSA-N |
| InChI | InChI=1S/C21H22ClN3O4/c1-14(19(26)12-15-8-5-7-11-18(15)22)24-29-13-16-9-4-6-10-17(16)20(25-28-3)21(27)23-2/h4-11H,12-13H2,1-3H3,(H,23,27)/b24-14+,25-20+ |
| SMILES | CNC(=O)/C(=N/OC)C1=C(CO/N=C(\C)C(=O)CC2=C(Cl)C=CC=C2)C=CC=C1 |
MNX internals
| InChI (mnx) | InChI=1/C21H22ClN3O4/c1-14(19(26)12-15-8-5-7-11-18(15)22)24-29-13-16-9-4-6-10-17(16)20(25-28-3)21(27)23-2/h4-11H,12-13H2,1-3H3,(H,23,27)/b24-14+,25-20+ |
 |
| SMILES (mnx) | [CH3:1]/[C:14]([C:19]([CH2:12][C:15]1=[CH:8][CH:5]=[CH:7][CH:11]=[C:18]1[Cl:22])=[O:26])=[N:24]\[O:29][CH2:13][C:16]1=[CH:9][CH:4]=[CH:6][CH:10]=[C:17]1[C:20](/[C:21](=[N:23]/[CH3:2])[OH:27])=[N:25]\[O:28][CH3:3] |
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