Vitas-M small molecule compound

5-{5-[(4-carboxyphenyl)sulfonyl]-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl}-2-hydroxybenzoic acid

Catalog ID
STK295804
SMILES O=C1N(c2ccc(c(c2)C(=O)O)O)C(=O)c2c1cc(cc2)S(=O)(=O)c1ccc(cc1)C(=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 C22H13NO9S MW 467.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H13NO9S/c24-18-8-3-12(9-17(18)22(29)30)23-19(25)15-7-6-14(10-16(15)20(23)26)33(31,32)13-4-1-11(2-5-13)21(27)28/h1-10,24H,(H,27,28)(H,29,30)
InChIKey
FZEPBVYKYHUQSQ-UHFFFAOYSA-N
Synonyms

5(5((4carboxyphenyl)sulfonyl)13dioxo13dihydro2Hisoindol2yl)2hydroxybenzoicacid
5(5((4CARBOXYPHENYL)SULFONYL)13DIOXOBENZO(C)AZOLIDIN2YL)2HYDROXYBENZOICACID
5(5(4CARBOXYBENZENESULFONYL)13DIOXO13DIHYDROISOINDOL2YL)2HYDROXYBENZOICACID
5(5(4CARBOXYPHENYL)SULFONYL13DIOXOISOINDOL2YL)2HYDROXYBENZOICACID
5(5(4CARBOXYPHENYL)SULFONYL13DIOXOISOINDOLIN2YL)2HYDROXYBENZOICACID
BENZOICACID5(5((4CARBOXYPHENYL)SULFONYL)13DIHYDRO13DIOXO2HISOINDOL2YL)2HYDROXY
C1=CC(=CC=C1C(=O)O)S(=O)(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)C4=CC(=C(C=C4)O)C(=O)O
InChI=1SC22H13NO9Sc24188312(917(18)22(29)30)2319(25)157614(1016(15)20(23)26)33(3132)134111(2513)21(27)28h11024H(H2728)(H2930)
MFCD00315637
ZINC000002903042
ZINC2903042

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.