Vitas-M small molecule compound
methyl (2Z)-2-(4-methylbenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-5-carboxylate
Catalog ID
STK516474
SMILES COC(=O)c1ccc2c(c1)C(=O)/C(=C/c1ccc(cc1)C)/O2
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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 C18H14O4 MW 294.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H14O4/c1-11-3-5-12(6-4-11)9-16-17(19)14-10-13(18(20)21-2)7-8-15(14)22-16/h3-10H,1-2H3/b16-9-InChIKey
WJKQIJKAMZWJDI-SXGWCWSVSA-NSynonyms
CC1=CC=C(C=C1)C=C2C(=O)C3=C(O2)C=CC(=C3)C(=O)OC
COC(=O)c1ccc2c(c1)C(=O)C(=Cc1ccc(cc1)C)O2
InChI=1SC18H14O4c1113512(6411)91617(19)141013(18(20)212)7815(14)2216h310H12H3b169
methyl(2Z)2((4methylphenyl)methylidene)3oxo1benzofuran5carboxylate
methyl(2Z)2(4methylbenzylidene)3oxo23dihydro1benzofuran5carboxylate
METHYL2((4METHYLPHENYL)METHYLENE)3OXOBENZO(B)FURAN5CARBOXYLATE
MFCD06645666
ZINC000005047763
ZINC05047763
ZINC5047763
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