| Properties | Image |
|---|
| MNX_ID | MNXM1176099 |
 |
| reference | envipathM:...a28688812df6 |
| formula | C14H13NO5S |
| global charge | 0 |
| mol weight | 307.327 |
| InChIKey | ZCIHHEPUERECPI-UHFFFAOYSA-N |
| InChI | InChI=1S/C14H13NO5S/c16-8-5-9(17)7-10(6-8)21(20)15-13(18)11-3-1-2-4-12(11)14(15)19/h1-4,8,10,16H,5-7H2 |
| SMILES | O=C1CC(O)CC(S(=O)N2C(=O)C3=C(C=CC=C3)C2=O)C1 |
MNX internals
| InChI (mnx) | InChI=1/C14H13NO5S/c16-8-5-9(17)7-10(6-8)21(20)15-13(18)11-3-1-2-4-12(11)14(15)19/h1-4,8,10,16H,5-7H2/t8?,10?,21? |
 |
| SMILES (mnx) | [CH:1]1=[CH:2][CH:4]=[C:12]2[C:11](=[CH:3]1)[C:13](=[O:18])[N:15]([S:21]([CH:10]1[CH2:6][CH:8]([OH:16])[CH2:5][C:9](=[O:17])[CH2:7]1)=[O:20])[C:14]2=[O:19] |
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