Vitas-M small molecule compound
9'-bromo-2,2-dimethyl-1',2',4',4a'-tetrahydro-6'H-spiro[1,3-dioxane-5,5'-[1,4]oxazino[4,3-a]quinoline]-4,6-dione
Catalog ID
STL448447
SMILES Brc1ccc2c(c1)N1CCOCC1C1(C2)C(=O)OC(OC1=O)(C)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 C17H18BrNO5 MW 396.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H18BrNO5/c1-16(2)23-14(20)17(15(21)24-16)8-10-3-4-11(18)7-12(10)19-5-6-22-9-13(17)19/h3-4,7,13H,5-6,8-9H2,1-2H3InChIKey
ITCXFEKPNBPJPF-UHFFFAOYSA-NSynonyms
9bromo22dimethyl1244atetrahydro6Hspiro(13dioxane55(14)oxazino(43a)quinoline)46dione
9bromo22dimethylspiro(13dioxane55244a6tetrahydro1H(14)oxazino(43a)quinoline)46dione
CC1(OC(=O)C2(CC3=C(C=C(C=C3)Br)N4C2COCC4)C(=O)O1)C
InChI=1SC17H18BrNO5c116(2)2314(20)17(15(21)2416)8103411(18)712(10)195622913(17)19h34713H5689H212H3
MFCD07773872
ZINC000004914422
ZINC000004914432
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