Vitas-M small molecule compound
methyl 4-[(Z)-{7-[(dibutylamino)methyl]-6-hydroxy-3-oxo-1-benzofuran-2(3H)-ylidene}methyl]benzoate
Catalog ID
STK992709
SMILES CCCCN(Cc1c(O)ccc2c1O/C(=C\c1ccc(cc1)C(=O)OC)/C2=O)CCCC
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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 C26H31NO5 MW 437.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H31NO5/c1-4-6-14-27(15-7-5-2)17-21-22(28)13-12-20-24(29)23(32-25(20)21)16-18-8-10-19(11-9-18)26(30)31-3/h8-13,16,28H,4-7,14-15,17H2,1-3H3/b23-16-InChIKey
CWPAXVVMKCWARC-KQWNVCNZSA-NSynonyms
929457-07-8(2Z)7((dibutylazaniumyl)methyl)2((4methoxycarbonylphenyl)methylidene)3oxo1benzofuran6olate
(Z)methyl4((7((dibutylamino)methyl)6hydroxy3oxobenzofuran2(3H)ylidene)methyl)benzoate
929457078
CCCC(NH+)(CCCC)CC1=C(C=CC2=C1OC(=CC3=CC=C(C=C3)C(=O)OC)C2=O)(O)
CCCCN(Cc1c(O)ccc2c1OC(=Cc1ccc(cc1)C(=O)OC)C2=O)CCCC
InChI=1SC26H31NO5c1461427(15752)172122(28)13122024(29)23(3225(20)21)161881019(11918)26(30)313h8131628H47141517H213H3b2316
methyl4((Z)(7((dibutylamino)methyl)6hydroxy3oxo1benzofuran2(3H)ylidene)methyl)benzoate
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