Vitas-M small molecule compound
(2E)-3-(2-bromo-5-methoxy-4-{2-[(2-methylphenyl)amino]-2-oxoethoxy}phenyl)prop-2-enoic acid
Catalog ID
STK398229
SMILES COc1cc(/C=C/C(=O)O)c(cc1OCC(=O)Nc1ccccc1C)Br
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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 C19H18BrNO5 MW 420.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18BrNO5/c1-12-5-3-4-6-15(12)21-18(22)11-26-17-10-14(20)13(7-8-19(23)24)9-16(17)25-2/h3-10H,11H2,1-2H3,(H,21,22)(H,23,24)/b8-7+InChIKey
OMQUANNLINIASA-BQYQJAHWSA-NSynonyms
(2E)3(2bromo5methoxy4(2((2methylphenyl)amino)2oxoethoxy)phenyl)prop2enoicacid
(E)3(2bromo5methoxy4(2(2methylanilino)2oxoethoxy)phenyl)prop2enoicacid
CC1=CC=CC=C1NC(=O)COC2=C(C=C(C(=C2)Br)C=CC(=O)O)OC
COc1cc(C=CC(=O)O)c(cc1OCC(=O)Nc1ccccc1C)Br
InChI=1SC19H18BrNO5c112534615(12)2118(22)1126171014(20)13(7819(23)24)916(17)252h310H11H212H3(H2122)(H2324)b87+
MFCD02256931
ZINC000022077379
ZINC22077379
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