Vitas-M small molecule compound

4-chloro-2-({[2-(2-methoxyphenyl)-1,3-dioxo-2,3-dihydro-1H-isoindol-5-yl]carbonyl}amino)benzoic acid

Catalog ID
STK033298
SMILES COc1ccccc1N1C(=O)c2c(C1=O)ccc(c2)C(=O)Nc1cc(Cl)ccc1C(=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 C23H15ClN2O6 MW 450.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H15ClN2O6/c1-32-19-5-3-2-4-18(19)26-21(28)14-8-6-12(10-16(14)22(26)29)20(27)25-17-11-13(24)7-9-15(17)23(30)31/h2-11H,1H3,(H,25,27)(H,30,31)
InChIKey
KMNGVXDQRWMTTB-UHFFFAOYSA-N
Synonyms

4CHLORO2(((2(2METHOXYPHENYL)13DIOXO23DIHYDRO1HISOINDOL5YL)CARBONYL)AMINO)BENZOICACID
4CHLORO2((2(2METHOXYPHENYL)13DIOXOISOINDOLE5CARBONYL)AMINO)BENZOICACID
COC1=CC=CC=C1N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)NC4=C(C=CC(=C4)Cl)C(=O)O
COc1ccccc1N1C(=O)c2c(C1=O)ccc(c2)C(=O)Nc1cc(Cl)ccc1C(=O)O
InChI=1SC23H15ClN2O6c13219532418(19)2621(28)148612(1016(14)22(26)29)20(27)25171113(24)7915(17)23(30)31h211H1H3(H2527)(H3031)
MFCD02032367
STK033298
ZINC000009144659
ZINC9144659

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Available files

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