Vitas-M small molecule compound
4-[(1E)-2-cyano-3-methoxy-3-oxoprop-1-en-1-yl]-2-methoxyphenyl 2,4-dichlorobenzoate
Catalog ID
STK596795
SMILES N#C/C(=C\c1ccc(c(c1)OC)OC(=O)c1ccc(cc1Cl)Cl)/C(=O)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 C19H13Cl2NO5 MW 406.22 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H13Cl2NO5/c1-25-17-8-11(7-12(10-22)18(23)26-2)3-6-16(17)27-19(24)14-5-4-13(20)9-15(14)21/h3-9H,1-2H3/b12-7+InChIKey
NUIJMJNJQVIKDR-KPKJPENVSA-NSynonyms
469875-72-7(4((E)2cyano3methoxy3oxoprop1enyl)2methoxyphenyl)24dichlorobenzoate
(E)4(2cyano3methoxy3oxoprop1en1yl)2methoxyphenyl24dichlorobenzoate
4((1E)2cyano3methoxy3oxoprop1en1yl)2methoxyphenyl24dichlorobenzoate
469875727
COC1=C(C=CC(=C1)C=C(C#N)C(=O)OC)OC(=O)C2=C(C=C(C=C2)Cl)Cl
InChI=1SC19H13Cl2NO5c12517811(712(1022)18(23)262)3616(17)2719(24)145413(20)915(14)21h39H12H3b127+
METHYL(2E)3(4(24DICHLOROPHENYLCARBONYLOXY)3METHOXYPHENYL)2CYANOPROP2ENOATE
MFCD02730365
N#CC(=Cc1ccc(c(c1)OC)OC(=O)c1ccc(cc1Cl)Cl)C(=O)OC
ZINC000000951072
ZINC00951072
ZINC951072
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