Vitas-M small molecule compound
ethyl 7-{[(2-bromophenyl)carbonyl]oxy}-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-oxo-4H-chromene-2-carboxylate
Catalog ID
STK922688
SMILES CCOC(=O)c1oc2cc(ccc2c(=O)c1c1ccc2c(c1)OCCO2)OC(=O)c1ccccc1Br
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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 C27H19BrO8 MW 551.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H19BrO8/c1-2-32-27(31)25-23(15-7-10-20-22(13-15)34-12-11-33-20)24(29)18-9-8-16(14-21(18)36-25)35-26(30)17-5-3-4-6-19(17)28/h3-10,13-14H,2,11-12H2,1H3InChIKey
ZSDZEIUGIIOJBP-UHFFFAOYSA-NSynonyms
3(2H3HBENZO(34E)14DIOXAN6YL)2(ETHOXYCARBONYL)4OXOCHROMEN7YL2BROMOBENZOATE
CCOC(=O)C1=C(C(=O)C2=C(O1)C=C(C=C2)OC(=O)C3=CC=CC=C3Br)C4=CC5=C(C=C4)OCCO5
ethyl7(((2bromophenyl)carbonyl)oxy)3(23dihydro14benzodioxin6yl)4oxo4Hchromene2carboxylate
ETHYL7(2BROMOBENZOYL)OXY3(23DIHYDRO14BENZODIOXIN6YL)4OXOCHROMENE2CARBOXYLATE
InChI=1SC27H19BrO8c123227(31)2523(157102022(1315)3412113320)24(29)189816(1421(18)3625)3526(30)17534619(17)28h3101314H21112H21H3
MFCD04181850
ZINC000011868175
ZINC11868175
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