Vitas-M small molecule compound

methyl 4-(4-hydroxy-3-iodophenyl)-2-methyl-5-oxo-4,5-dihydro-1H-indeno[1,2-b]pyridine-3-carboxylate

Catalog ID
STL374240
SMILES COC(=O)C1=C(C)NC2=C(C1c1ccc(c(c1)I)O)C(=O)c1c2cccc1

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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 C21H16INO4 MW 473.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16INO4/c1-10-16(21(26)27-2)17(11-7-8-15(24)14(22)9-11)18-19(23-10)12-5-3-4-6-13(12)20(18)25/h3-9,17,23-24H,1-2H3
InChIKey
HDMLREMQJSIMQW-UHFFFAOYSA-N
Synonyms

CC1=C(C(C2=C(N1)C3=CC=CC=C3C2=O)C4=CC(=C(C=C4)O)I)C(=O)OC
InChI=1SC21H16INO4c11016(21(26)272)17(117815(24)14(22)911)1819(2310)12534613(12)20(18)25h39172324H12H3
METHYL4(4HYDROXY3IODOPHENYL)2METHYL5OXO14DIHYDROINDENO(12B)PYRIDINE3CARBOXYLATE
methyl4(4hydroxy3iodophenyl)2methyl5oxo45dihydro1Hindeno(12b)pyridine3carboxylate
MFCD02635630
ZINC000001220273
ZINC000019792723

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Available files

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