Vitas-M small molecule compound

(2Z)-3-oxo-2-(3,4,5-trimethoxybenzylidene)-2,3-dihydro-1-benzofuran-6-yl 4-chlorobutanoate

Catalog ID
STK849538
SMILES ClCCCC(=O)Oc1ccc2c(c1)O/C(=C\c1cc(OC)c(c(c1)OC)OC)/C2=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 C22H21ClO7 MW 432.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21ClO7/c1-26-18-10-13(11-19(27-2)22(18)28-3)9-17-21(25)15-7-6-14(12-16(15)30-17)29-20(24)5-4-8-23/h6-7,9-12H,4-5,8H2,1-3H3/b17-9-
InChIKey
UAYJCTXJXOKTKR-MFOYZWKCSA-N
Synonyms
896073-26-0
((2Z)3OXO2((345TRIMETHOXYPHENYL)METHYLIDENE)1BENZOFURAN6YL)4CHLOROBUTANOATE
(2Z)3oxo2(345trimethoxybenzylidene)23dihydro1benzofuran6yl4chlorobutanoate
(Z)3OXO2(345TRIMETHOXYBENZYLIDENE)23DIHYDROBENZOFURAN6YL4CHLOROBUTANOATE
3OXO2((345TRIMETHOXYPHENYL)METHYLENE)BENZO(34B)FURAN6YL4CHLOROBUTANOATE
896073260
ClCCCC(=O)Oc1ccc2c(c1)OC(=Cc1cc(OC)c(c(c1)OC)OC)C2=O
COC1=CC(=CC(=C1OC)OC)C=C2C(=O)C3=C(O2)C=C(C=C3)OC(=O)CCCCl
InChI=1SC22H21ClO7c126181013(1119(272)22(18)283)91721(25)157614(1216(15)3017)2920(24)54823h67912H458H213H3b179
MFCD06592172
ZINC000002437225
ZINC02437225
ZINC2437225

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Available files

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