Vitas-M small molecule compound
4-[(E)-2-(4-chlorophenyl)-2-cyanoethenyl]-2-methoxyphenyl 2-oxo-2H-chromene-3-carboxylate
Catalog ID
STL332093
SMILES N#C/C(=C/c1ccc(c(c1)OC)OC(=O)c1cc2ccccc2oc1=O)/c1ccc(cc1)Cl
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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 C26H16ClNO5 MW 457.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H16ClNO5/c1-31-24-13-16(12-19(15-28)17-7-9-20(27)10-8-17)6-11-23(24)33-26(30)21-14-18-4-2-3-5-22(18)32-25(21)29/h2-14H,1H3/b19-12-InChIKey
DHVDFWCWCWIGJF-UNOMPAQXSA-NSynonyms
302574-98-7(4((E)2(4CHLOROPHENYL)2CYANOETHENYL)2METHOXYPHENYL)2OXOCHROMENE3CARBOXYLATE
(E)4(2(4chlorophenyl)2cyanovinyl)2methoxyphenyl2oxo2Hchromene3carboxylate
302574987
4((E)2(4chlorophenyl)2cyanoethenyl)2methoxyphenyl2oxo2Hchromene3carboxylate
COC1=C(C=CC(=C1)C=C(C#N)C2=CC=C(C=C2)Cl)OC(=O)C3=CC4=CC=CC=C4OC3=O
InChI=1SC26H16ClNO5c131241316(1219(1528)177920(27)10817)61123(24)3326(30)211418423522(18)3225(21)29h214H1H3b1912
MFCD03000590
N#CC(=Cc1ccc(c(c1)OC)OC(=O)c1cc2ccccc2oc1=O)c1ccc(cc1)Cl
ZINC000013534247
ZINC13534247
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