RefChem:319124

(2-benzoyloxy-2-cyanocyclohexyl)methyl-[2-[4-[2-[(2-benzoyloxy-2-cyanocyclohexyl)methyl-dimethylazaniumyl]acetyl]phenyl]-2-oxoethyl]-dimethylazanium dibromide

Also Known As: AC1L1QXR|RefChem:319124|Ammonium, (terephthaloyldimethylene)bis(((2-cyano-2-hydroxycyclohexyl)methyl)dimethyl-, dibromide, dibenzoate (ester)|(2-benzoyloxy-2-cyanocyclohexyl)methyl-[2-[4-[2-[(2-benzoyloxy-2-cyanocyclohexyl)methyl-dimethylazaniumyl]acetyl]phenyl]-2-oxoethyl]-dimethylazanium dibromide|AMMONIUM, (TEREPHTHALOYLDIMETHYLENE)BIS(((2-CYANO-2-HYDROXYCYCLOHEXYL)METHYL)DIM|2,2'-(1,4-Phenylene)bis(N-{[2-(benzoyloxy)-2-cyanocyclohexyl]methyl}-N,N-dimethyl-2-oxoethan-1-aminium) dibromide

Molecular Formula	C44H52Br2N4O6
Molecular Weight	890.22534 g/mol
LogP	0.83
Topological Polar Surface Area	134.32 Ų
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	8
Rotatable Bonds	14
Exact Mass	892.2233
Heavy Atoms	56
Complexity	1770.7

Chemical Identifiers

CAS Number	28003-38-5
SMILES	C[N+](C)(CC1CCCCC1(C#N)OC(=O)C2=CC=CC=C2)CC(=O)C3=CC=C(C=C3)C(=O)C[N+](C)(C)CC4CCCCC4(C#N)OC(=O)C5=CC=CC=C5.[Br-].[Br-]