Vitas-M small molecule compound

methyl 2-{[(2Z)-2-(1,3-benzodioxol-5-ylmethylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-yl]oxy}propanoate

Catalog ID
STL033407
SMILES COC(=O)C(Oc1ccc2c(c1)O/C(=C\c1ccc3c(c1)OCO3)/C2=O)C

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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 C20H16O7 MW 368.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16O7/c1-11(20(22)23-2)26-13-4-5-14-16(9-13)27-18(19(14)21)8-12-3-6-15-17(7-12)25-10-24-15/h3-9,11H,10H2,1-2H3/b18-8-
InChIKey
OYDWLBSXHHTCIA-LSCVHKIXSA-N
Synonyms
859661-68-0
(Z)methyl2((2(benzo(d)(13)dioxol5ylmethylene)3oxo23dihydrobenzofuran6yl)oxy)propanoate
859661680
CC(C(=O)OC)OC1=CC2=C(C=C1)C(=O)C(=CC3=CC4=C(C=C3)OCO4)O2
COC(=O)C(Oc1ccc2c(c1)OC(=Cc1ccc3c(c1)OCO3)C2=O)C
InChI=1SC20H16O7c111(20(22)232)2613451416(913)2718(19(14)21)812361517(712)25102415h3911H10H212H3b188
METHYL2(((2Z)2(13BENZODIOXOL5YLMETHYLIDENE)3OXO1BENZOFURAN6YL)OXY)PROPANOATE
methyl2(((2Z)2(13benzodioxol5ylmethylidene)3oxo23dihydro1benzofuran6yl)oxy)propanoate
METHYL2(2(2HBENZO(34D)13DIOXOLEN5YLMETHYLENE)3OXOBENZO(34B)FURAN6YLOXY)PROPANOATE
MFCD06494467
ZINC000005961499
ZINC000006072798

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Available files

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