Vitas-M small molecule compound
3-(acetylamino)-4-carboxybenzenesulfonate
Catalog ID
STK367987
SMILES CC(=O)Nc1cc(ccc1C(=O)O)S(=O)(=O)[O-]
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C9H8NO6S MW 258.23 g/mol Purity >90% as per NMR
InChI
InChI=1S/C9H9NO6S/c1-5(11)10-8-4-6(17(14,15)16)2-3-7(8)9(12)13/h2-4H,1H3,(H,10,11)(H,12,13)(H,14,15,16)/p-1InChIKey
QNDMAZMTITWLDT-UHFFFAOYSA-MSynonyms
3(acetylamino)4carboxybenzenesulfonate
3ACETAMIDO4CARBOXYBENZENESULFONATE
CC(=O)NC1=C(C=CC(=C1)S(=O)(=O)(O))C(=O)O
CC(=O)Nc1cc(ccc1C(=O)O)S(=O)(=O)(O)
InChI=1SC9H9NO6Sc15(11)10846(17(1415)16)237(8)9(12)13h24H1H3(H1011)(H1213)(H141516)p1
MFCD00688052
ZINC000003161264
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