Vitas-M small molecule compound

(2Z)-2-(3-methoxybenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-yl 1,3-benzodioxole-5-carboxylate

Catalog ID
STK923775
SMILES COc1cccc(c1)/C=C/1\Oc2c(C1=O)ccc(c2)OC(=O)c1ccc2c(c1)OCO2

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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 C24H16O7 MW 416.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H16O7/c1-27-16-4-2-3-14(9-16)10-22-23(25)18-7-6-17(12-20(18)31-22)30-24(26)15-5-8-19-21(11-15)29-13-28-19/h2-12H,13H2,1H3/b22-10-
InChIKey
CXRGJIRUWWEJSO-YVNNLAQVSA-N
Synonyms
858760-03-9
((2Z)2((3METHOXYPHENYL)METHYLIDENE)3OXO1BENZOFURAN6YL)13BENZODIOXOLE5CARBOXYLATE
(2Z)2(3methoxybenzylidene)3oxo23dihydro1benzofuran6yl13benzodioxole5carboxylate
(Z)2(3methoxybenzylidene)3oxo23dihydrobenzofuran6ylbenzo(d)(13)dioxole5carboxylate
2((3METHOXYPHENYL)METHYLENE)3OXOBENZO(34B)FURAN6YL2HBENZO(34D)13DIOXOLENE5CARBOXYLATE
858760039
COC1=CC=CC(=C1)C=C2C(=O)C3=C(O2)C=C(C=C3)OC(=O)C4=CC5=C(C=C4)OCO5
COc1cccc(c1)C=C1Oc2c(C1=O)ccc(c2)OC(=O)c1ccc2c(c1)OCO2
InChI=1SC24H16O7c1271642314(916)102223(25)187617(1220(18)3122)3024(26)15581921(1115)29132819h212H13H21H3b2210
MFCD04142750
ZINC000002153657
ZINC02153657
ZINC2153657

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.