Vitas-M small molecule compound

(2Z)-2-(3,4-dimethoxybenzylidene)-6-hydroxy-7-(piperidin-1-ylmethyl)-1-benzofuran-3(2H)-one

Catalog ID
STK924359
SMILES COc1cc(ccc1OC)/C=C/1\Oc2c(C1=O)ccc(c2CN1CCCCC1)O

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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 C23H25NO5 MW 395.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H25NO5/c1-27-19-9-6-15(12-20(19)28-2)13-21-22(26)16-7-8-18(25)17(23(16)29-21)14-24-10-4-3-5-11-24/h6-9,12-13,25H,3-5,10-11,14H2,1-2H3/b21-13-
InChIKey
XOSALYYWAMYXNF-BKUYFWCQSA-N
Synonyms
869077-34-9
(2Z)2((34dimethoxyphenyl)methylidene)3oxo7(piperidin1ium1ylmethyl)1benzofuran6olate
(2Z)2((34DIMETHOXYPHENYL)METHYLIDENE)6HYDROXY7(PIPERIDIN1YLMETHYL)1BENZOFURAN3ONE
(2Z)2(34dimethoxybenzylidene)6hydroxy7(piperidin1ylmethyl)1benzofuran3(2H)one
(Z)2(34dimethoxybenzylidene)6hydroxy7(piperidin1ylmethyl)benzofuran3(2H)one
2((34DIMETHOXYPHENYL)METHYLENE)6HYDROXY7(PIPERIDYLMETHYL)BENZO(B)FURAN3ONE
2(34DIMETHOXYBENZYLIDENE)6HYDROXY7(1PIPERIDINYLMETHYL)1BENZOFURAN3(2H)ONE
COC1=C(C=C(C=C1)C=C2C(=O)C3=C(O2)C(=C(C=C3)(O))C(NH+)4CCCCC4)OC
COc1cc(ccc1OC)C=C1Oc2c(C1=O)ccc(c2CN1CCCCC1)O
InChI=1SC23H25NO5c127199615(1220(19)282)132122(26)167818(25)17(23(16)2921)1424104351124h69121325H35101114H212H3b2113
ZINC20759878

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Available files

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