Belladonnine bis(ethobromide)

bis(8-ethyl-8-methyl-8-azoniabicyclo[3.2.1]octan-3-yl) 4-phenyl-2,3-dihydro-1H-naphthalene-1,4-dicarboxylate dibromide

Also Known As: Belladonnine bis(ethobromide)|Belladonnine bis(bromoethylate)|1-alpha-H,5-alpha-H-Tropanium, 8-ethyl-3-alpha-hydroxy-, bromide, 1,2,3,4-tetrahydro-1-phenyl-1,4-naphthalenedicarboxylate (2:1)|1.alpha.H,5.alpha.H-Tropanium, 8-ethyl-3.alpha.-hydroxy-, bromide, 1,2,3,4-tetrahydro-1-phenyl-1,4-naphthalenedicarboxylate (2:1)|3,3'-[(1-Phenyl-1,2,3,4-tetrahydronaphthalene-1,4-diyl)bis(carbonyloxy)]bis(8-ethyl-8-methyl-8-azabicyclo[3.2.1]octan-8-ium) dibromide|8-Azoniabicyclo[3.2.1]octane, 3,3'-[(1,2,3,4-tetrahydro-1-phenyl-1,4-naphthalenediyl)bis(carbonyloxy)]bis[8-ethyl-8-methyl-,dibromide|bis(8-ethyl-8-methyl-8-azoniabicyclo[3.2.1]octan-3-yl) 4-phenyl-2,3-dihydro-1H-naphthalene-1,4-dicarboxylate dibromide

Molecular Formula	C38H52Br2N2O4
Molecular Weight	758.2294 g/mol
LogP	0.2643
Topological Polar Surface Area	52.6 Ų
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	6
Rotatable Bonds	9
Exact Mass	758.2294
Monoisotopic Mass	758.2294
Heavy Atoms	46
Complexity	1040.0

Chemical Identifiers

CAS Number	5908-90-7
SMILES	CC[N+]1(C2CCC1CC(C2)OC(=O)C3CCC(C4=CC=CC=C34)(C5=CC=CC=C5)C(=O)OC6CC7CCC(C6)[N+]7(C)CC)C.[Br-].[Br-]
InChIKey	LSGZDWDVTHECJK-UHFFFAOYSA-L