| Properties | Image |
|---|
| MNX_ID | MNXM1195888 |
 |
| reference | envipathM:...fa9bb010bc2d |
| formula | C16H15ClN2O6 |
| global charge | 0 |
| mol weight | 366.757 |
| InChIKey | BAXVUALKIXVWMQ-UHFFFAOYSA-N |
| InChI | InChI=1S/C16H15ClN2O6/c1-19-8-3-2-6(17)4-7(8)12(18-15(24)16(19)25)11-9(20)5-10(21)13(22)14(11)23/h2-5,11,13-15,21-24H,1H3 |
| SMILES | CN1C(=O)C(O)N=C(C2C(=O)C=C(O)C(O)C2O)C2=C1C=CC(Cl)=C2 |
MNX internals
| InChI (mnx) | InChI=1/C16H15ClN2O6/c1-19-8-3-2-6(17)4-7(8)12(18-15(24)16(19)25)11-9(20)5-10(21)13(22)14(11)23/h2-5,11,13-15,21-24H,1H3/t11?,13?,14?,15? |
 |
| SMILES (mnx) | [CH3:1][N:19]1[C:8]2=[C:7]([CH:4]=[C:6]([Cl:17])[CH:2]=[CH:3]2)[C:12]([CH:11]2[C:9](=[O:20])[CH:5]=[C:10]([OH:21])[CH:13]([OH:22])[CH:14]2[OH:23])=[N:18][CH:15]([OH:24])[C:16]1=[O:25] |
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