Vitas-M small molecule compound

2-chloro-5-{[(4,5-dimethoxy-3-oxo-1,3-dihydro-2-benzofuran-1-yl)acetyl]amino}benzoic acid

Catalog ID
STL494376
SMILES COc1c(OC)ccc2c1C(=O)OC2CC(=O)Nc1ccc(c(c1)C(=O)O)Cl

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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 C19H16ClNO7 MW 405.79 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16ClNO7/c1-26-13-6-4-10-14(28-19(25)16(10)17(13)27-2)8-15(22)21-9-3-5-12(20)11(7-9)18(23)24/h3-7,14H,8H2,1-2H3,(H,21,22)(H,23,24)
InChIKey
KSTCJQZOCQNNLM-UHFFFAOYSA-N
Synonyms
1630905-99-5
1630905995
2chloro5(((45dimethoxy3oxo13dihydro2benzofuran1yl)acetyl)amino)benzoicacid
2chloro5((2(45dimethoxy3oxo1H2benzofuran1yl)acetyl)amino)benzoicacid
2chloro5(2(45dimethoxy3oxo13dihydroisobenzofuran1yl)acetamido)benzoicacid
COC1=C(C2=C(C=C1)C(OC2=O)CC(=O)NC3=CC(=C(C=C3)Cl)C(=O)O)OC
InChI=1SC19H16ClNO7c12613641014(2819(25)16(10)17(13)272)815(22)2193512(20)11(79)18(23)24h3714H8H212H3(H2122)(H2324)
MFCD28367215
ZINC000218232359
ZINC000218232399

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Available files

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