Registration Dossier

Diss Factsheets

IUPAC name:
rel-(4aR,8aR)-1-bromo-3-methoxy-4a,5,9,10,11,12-hexahydro-6H-[1]benzofuro[3a,3,2-ef][2]benzazepin-6-one hydrochloride (1:1)

Inventory

Synonyms

Molecular and structural information

Molecular formula:
C16H16BrNO3.HCl
Molecular weight:
ca. 386.67
SMILES notation:
COc1cc(Br)c2CNCCC34C=CC(=O)CC3Oc1c24
InChl:
InChI=1S/C16H16BrNO3/c1-20-12-7-11(17)10-8-18-5-4-16-3-2-9(19)6-13(16)21-15(12)14(10)16/h2-3,7,13,18H,4-6,8H2,1H3
Structural formula:
Chemical structure

Related substances

Identifier:
EC number
Identity:
EC 605-847-5