| Properties | Image |
|---|
| MNX_ID | MNXM1195793 |
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| reference | envipathM:...36b311d18c25 |
| formula | C14H10ClNO7 |
| global charge | -2 |
| mol weight | 339.687 |
| InChIKey | QBCAPUAQQMTHOF-CPGMINKOSA-L |
| InChI | InChI=1S/C14H12ClNO7/c15-6-8(17)9(11(18)13(20)21)10(16-12(19)14(22)23)7-4-2-1-3-5-7/h1-6,9,12,17,19H,(H,20,21)(H,22,23)/p-2/b8-6-,16-10? |
| SMILES | O=C([O-])C(=O)C(C(=NC(O)C(=O)[O-])C1=CC=CC=C1)/C(O)=C/Cl |
MNX internals
| InChI (mnx) | InChI=1/C14H12ClNO7/c15-6-8(17)9(11(18)13(20)21)10(16-12(19)14(22)23)7-4-2-1-3-5-7/h1-6,9,12,17,19H,(H,20,21)(H,22,23)/b8-6-,16-10?/t9?,12? |
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| SMILES (mnx) | [CH:1]1=[CH:2][CH:4]=[C:7]([C:10]([CH:9](/[C:8](=[CH:6]/[Cl:15])[OH:17])[C:11]([C:13]([OH:20])=[O:21])=[O:18])=[N:16][CH:12]([C:14](=[O:22])[OH:23])[OH:19])[CH:5]=[CH:3]1 |
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