Vitas-M small molecule compound
2-ethoxy-2-oxoethyl 2-(3-chlorophenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxylate
Catalog ID
STL104554
SMILES CCOC(=O)COC(=O)c1cn(c2cccc(c2)Cl)c(=O)c2c1cccc2
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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 C20H16ClNO5 MW 385.80 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16ClNO5/c1-2-26-18(23)12-27-20(25)17-11-22(14-7-5-6-13(21)10-14)19(24)16-9-4-3-8-15(16)17/h3-11H,2,12H2,1H3InChIKey
BXKFDZGXMCGXMA-UHFFFAOYSA-NSynonyms
1226457-01-7(2ethoxy2oxoethyl)2(3chlorophenyl)1oxoisoquinoline4carboxylate
1226457017
2ethoxy2oxoethyl2(3chlorophenyl)1oxo12dihydroisoquinoline4carboxylate
CCOC(=O)COC(=O)C1=CN(C(=O)C2=CC=CC=C21)C3=CC(=CC=C3)Cl
InChI=1SC20H16ClNO5c122618(23)122720(25)171122(1475613(21)1014)19(24)16943815(16)17h311H212H21H3
MFCD16640022
ZINC000044168171
ZINC44168171
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