Vitas-M small molecule compound
2-[(3-chloro-4-methoxyphenyl)amino]-2-oxoethyl (2E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoate
Catalog ID
STL187548
SMILES COc1cc(/C=C/C(=O)OCC(=O)Nc2ccc(c(c2)Cl)OC)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 C21H22ClNO7 MW 435.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22ClNO7/c1-26-16-7-6-14(11-15(16)22)23-19(24)12-30-20(25)8-5-13-9-17(27-2)21(29-4)18(10-13)28-3/h5-11H,12H2,1-4H3,(H,23,24)/b8-5+InChIKey
GBAOXLHWLIYIKL-VMPITWQZSA-NSynonyms
(2(3chloro4methoxyanilino)2oxoethyl)(E)3(345trimethoxyphenyl)prop2enoate
2((3chloro4methoxyphenyl)amino)2oxoethyl(2E)3(345trimethoxyphenyl)prop2enoate
COC1=C(C=C(C=C1)NC(=O)COC(=O)C=CC2=CC(=C(C(=C2)OC)OC)OC)Cl
COc1cc(C=CC(=O)OCC(=O)Nc2ccc(c(c2)Cl)OC)cc(c1OC)OC
InChI=1SC21H22ClNO7c126167614(1115(16)22)2319(24)123020(25)8513917(272)21(294)18(1013)283h511H12H214H3(H2324)b85+
MFCD05286236
ZINC000028280099
ZINC28280099
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