Vitas-M small molecule compound
6,8-dibromo-10a-(morpholin-4-ium-4-yl)-1-oxo-2,3,4,5,5a,10a-hexahydro-1H-[1]benzofuro[2,3-c]azepin-7-olate
Catalog ID
STK559775
SMILES O=C1NCCCC2C1(Oc1c2c(Br)c(c(c1)Br)[O-])[NH+]1CCOCC1
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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 C16H18Br2N2O4 MW 462.14 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18Br2N2O4/c17-10-8-11-12(13(18)14(10)21)9-2-1-3-19-15(22)16(9,24-11)20-4-6-23-7-5-20/h8-9,21H,1-7H2,(H,19,22)InChIKey
BGQRLZNCFLCUPZ-UHFFFAOYSA-NSynonyms
577700-33-5577700335
68dibromo10a(morpholin4ium4yl)1oxo23455a10ahexahydro1H(1)benzofuro(23c)azepin7olate
68dibromo7hydroxy10amorpholin4yl3455atetrahydro2H(1)benzofuro(23c)azepin1one
C1CC2C3=C(C(=C(C=C3OC2(C(=O)NC1)N4CCOCC4)Br)O)Br
InChI=1SC16H18Br2N2O4c171081112(13(18)14(10)21)92131915(22)16(92411)2046237520h8921H17H2(H1922)
MFCD04027906
O=C1NCCCC2C1(Oc1c2c(Br)c(c(c1)Br)(O))(NH+)1CCOCC1
ZINC000019858012
ZINC000019858017
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