Vitas-M small molecule compound

(2Z)-2-(1,3-benzodioxol-5-ylmethylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-yl 2-methoxybenzoate

Catalog ID
STL033461
SMILES COc1ccccc1C(=O)Oc1ccc2c(c1)O/C(=C\c1ccc3c(c1)OCO3)/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 C24H16O7 MW 416.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H16O7/c1-27-18-5-3-2-4-17(18)24(26)30-15-7-8-16-20(12-15)31-22(23(16)25)11-14-6-9-19-21(10-14)29-13-28-19/h2-12H,13H2,1H3/b22-11-
InChIKey
WBSNNTBEDPRXCS-JJFYIABZSA-N
Synonyms
859660-81-4
((2Z)2(13BENZODIOXOL5YLMETHYLIDENE)3OXO1BENZOFURAN6YL)2METHOXYBENZOATE
(2Z)2(13benzodioxol5ylmethylidene)3oxo23dihydro1benzofuran6yl2methoxybenzoate
(Z)2(benzo(d)(13)dioxol5ylmethylene)3oxo23dihydrobenzofuran6yl2methoxybenzoate
2(2HBENZO(34D)13DIOXOLEN5YLMETHYLENE)3OXOBENZO(34B)FURAN6YL2METHOXYBENZOATE
859660814
COC1=CC=CC=C1C(=O)OC2=CC3=C(C=C2)C(=O)C(=CC4=CC5=C(C=C4)OCO5)O3
COc1ccccc1C(=O)Oc1ccc2c(c1)OC(=Cc1ccc3c(c1)OCO3)C2=O
InChI=1SC24H16O7c12718532417(18)24(26)3015781620(1215)3122(23(16)25)1114691921(1014)29132819h212H13H21H3b2211
MFCD06493860
ZINC000008788809
ZINC08788809
ZINC8788809

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Available files

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