Vitas-M small molecule compound
9-bromo-5,5-diethyl-5H-isoindolo[2,1-a][3,1]benzoxazin-11(6aH)-one
Catalog ID
STK695063
SMILES CCC1(CC)OC2c3ccc(cc3C(=O)N2c2c1cccc2)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 C19H18BrNO2 MW 372.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18BrNO2/c1-3-19(4-2)15-7-5-6-8-16(15)21-17(22)14-11-12(20)9-10-13(14)18(21)23-19/h5-11,18H,3-4H2,1-2H3InChIKey
LUPKPSAMZMPYMR-UHFFFAOYSA-NSynonyms
9bromo55diethyl5Hisoindolo(21a)(31)benzoxazin11(6aH)one
9bromo55diethyl6aHisoindolo(23a)(31)benzoxazin11one
CCC1(C2=CC=CC=C2N3C(O1)C4=C(C3=O)C=C(C=C4)Br)CC
InChI=1SC19H18BrNO2c1319(42)15756816(15)2117(22)141112(20)91013(14)18(21)2319h51118H34H212H3
MFCD12035297
ZINC000035326849
ZINC000035326852
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