Vitas-M small molecule compound
2-[(2-chlorobenzyl)amino]-2-oxoethyl (2E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoate
Catalog ID
STL187522
SMILES COc1cc(/C=C/C(=O)OCC(=O)NCc2ccccc2Cl)cc(c1OC)OC
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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 C21H22ClNO6 MW 419.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22ClNO6/c1-26-17-10-14(11-18(27-2)21(17)28-3)8-9-20(25)29-13-19(24)23-12-15-6-4-5-7-16(15)22/h4-11H,12-13H2,1-3H3,(H,23,24)/b9-8+InChIKey
JDNGNEYHWOEKPU-CMDGGOBGSA-NSynonyms
(2((2chlorophenyl)methylamino)2oxoethyl)(E)3(345trimethoxyphenyl)prop2enoate
2((2chlorobenzyl)amino)2oxoethyl(2E)3(345trimethoxyphenyl)prop2enoate
COC1=CC(=CC(=C1OC)OC)C=CC(=O)OCC(=O)NCC2=CC=CC=C2Cl
COc1cc(C=CC(=O)OCC(=O)NCc2ccccc2Cl)cc(c1OC)OC
InChI=1SC21H22ClNO6c126171014(1118(272)21(17)283)8920(25)291319(24)231215645716(15)22h411H1213H213H3(H2324)b98+
MFCD05286232
ZINC000003415348
ZINC3415348
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