Vitas-M small molecule compound
ethyl {2-chloro-4-[(1,3-dioxo-1,3-dihydro-2H-inden-2-ylidene)methyl]-6-ethoxyphenoxy}acetate
Catalog ID
STK958415
SMILES CCOC(=O)COc1c(Cl)cc(cc1OCC)/C=C/1\C(=O)c2c(C1=O)cccc2
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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 C22H19ClO6 MW 414.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19ClO6/c1-3-27-18-11-13(10-17(23)22(18)29-12-19(24)28-4-2)9-16-20(25)14-7-5-6-8-15(14)21(16)26/h5-11H,3-4,12H2,1-2H3InChIKey
CFIXWGAAXGABHT-UHFFFAOYSA-NSynonyms
445254-00-2445254002
CCOC(=O)COc1c(Cl)cc(cc1OCC)C=C1C(=O)c2c(C1=O)cccc2
CCOC1=C(C(=CC(=C1)C=C2C(=O)C3=CC=CC=C3C2=O)Cl)OCC(=O)OCC
ethyl(2chloro4((13dioxo13dihydro2Hinden2ylidene)methyl)6ethoxyphenoxy)acetate
ETHYL2(2CHLORO4((13DIOXOINDEN2YLIDENE)METHYL)6ETHOXYPHENOXY)ACETATE
InChI=1SC22H19ClO6c1327181113(1017(23)22(18)291219(24)2842)91620(25)14756815(14)21(16)26h511H3412H212H3
MFCD02054395
ZINC000002748727
ZINC02748727
ZINC2748727
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