[2-(2,2-diphenylethanoyloxy)-1-phenyl-ethyl]-trimethyl-azanium bromide

Systemtic Name: [2-(2,2-diphenylethanoyloxy)-1-phenyl-ethyl]-trimethyl-azanium bromide Openeye Name: [2-(2,2-diphenylacetyl)oxy-1-phenyl-ethyl]-trimethyl-ammonium bromide CAS Name: trimethyl-[2-(1-oxo-2,2-diphenylethoxy)-1-phenylethyl]ammonium bromide IUPAC Name: [2-(2,2-diphenylacetyl)oxy-1-phenylethyl]-trimethylazanium bromide Traditional Name: [2-(2,2-diphenylacetyl)oxy-1-phenyl-ethyl]-trimethyl-ammonium bromide Formula: C25H28BrNO2 MolecularWeight: 454.39932

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)C(COC(=O)C(C1=CC=CC=C1)C2=CC=CC=C2)C3=CC=CC=C3.[Br-]

Isomeric SMILES

C[N+](C)(C)C(COC(=O)C(C1=CC=CC=C1)C2=CC=CC=C2)C3=CC=CC=C3.[Br-]

InChI

InChI=1S/C25H28NO2.BrH/c1-26(2,3)23(20-13-7-4-8-14-20)19-28-25(27)24(21-15-9-5-10-16-21)22-17-11-6-12-18-22;/h4-18,23-24H,19H2,1-3H3;1H/q+1;/p-1