| Properties | Image |
| MNX_ID | MNXM34702 |
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| reference | chebi:45957 |
| formula | C12H11NO7S2 |
| global charge | 0 |
| mol weight | 345.354 |
| InChIKey | WGOQGHNONXFNJQ-UHFFFAOYSA-N |
| InChI | InChI=1S/C12H11NO7S2/c1-7(14)13-10-6-5-8-9(12(10)22(18,19)20)3-2-4-11(8)21(15,16)17/h2-6H,1H3,(H,13,14)(H,15,16,17)(H,18,19,20) |
| SMILES | CC(=O)NC1=CC=C2C(S(=O)(=O)O)=CC=CC2=C1S(=O)(=O)O |
MNX internals
| InChI (mnx) | InChI=1/C12H11NO7S2/c1-7(14)13-10-6-5-8-9(12(10)22(18,19)20)3-2-4-11(8)21(15,16)17/h2-6H,1H3,(H,13,14)(H,15,16,17)(H,18,19,20) |
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| SMILES (mnx) | [CH3:1][C:7](=[N:13][C:10]1=[C:12]([S:22]([OH:18])(=[O:19])=[O:20])[C:9]2=[C:8]([CH:5]=[CH:6]1)[C:11]([S:21]([OH:15])(=[O:16])=[O:17])=[CH:4][CH:2]=[CH:3]2)[OH:14] |
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