Vitas-M small molecule compound
5,7-dibromoquinolin-8-yl 4,7,7-trimethyl-3-oxo-2-oxabicyclo[2.2.1]heptane-1-carboxylate
Catalog ID
STK966306
SMILES O=C(C12CCC(C2(C)C)(C(=O)O1)C)Oc1c(Br)cc(c2c1nccc2)Br
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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 C19H17Br2NO4 MW 483.16 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H17Br2NO4/c1-17(2)18(3)6-7-19(17,26-15(18)23)16(24)25-14-12(21)9-11(20)10-5-4-8-22-13(10)14/h4-5,8-9H,6-7H2,1-3H3InChIKey
LXGGFZUCLIMPHU-UHFFFAOYSA-NSynonyms
(1R4S)57dibromoquinolin8yl477trimethyl3oxo2oxabicyclo(221)heptane1carboxylate
(57DIBROMOQUINOLIN8YL)177TRIMETHYL2OXO3OXABICYCLO(221)HEPTANE4CARBOXYLATE
57DIBROMO8QUINOLYL477TRIMETHYL3OXO2OXABICYCLO(221)HEPTANECARBOXYLATE
57dibromoquinolin8yl477trimethyl3oxo2oxabicyclo(221)heptane1carboxylate
CC1(C2(CCC1(OC2=O)C(=O)OC3=C(C=C(C4=C3N=CC=C4)Br)Br)C)C
InChI=1SC19H17Br2NO4c117(2)18(3)6719(172615(18)23)16(24)251412(21)911(20)105482213(10)14h4589H67H213H3
MFCD03668224
ZINC000001099058
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