diethyl-methyl-[2-(3-oxidanyl-2-phenyl-hexanoyl)oxyethyl]azanium bromide

Systemtic Name: diethyl-methyl-[2-(3-oxidanyl-2-phenyl-hexanoyl)oxyethyl]azanium bromide Openeye Name: diethyl-[2-(3-hydroxy-2-phenyl-hexanoyl)oxyethyl]-methyl-ammonium bromide CAS Name: diethyl-[2-(3-hydroxy-1-oxo-2-phenylhexoxy)ethyl]-methylammonium bromide IUPAC Name: diethyl-[2-(3-hydroxy-2-phenylhexanoyl)oxyethyl]-methylazanium bromide Traditional Name: diethyl-[2-(3-hydroxy-2-phenyl-hexanoyl)oxyethyl]-methyl-ammonium bromide Formula: C19H32BrNO3 MolecularWeight: 402.36628

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(C1=CC=CC=C1)C(=O)OCC[N+](C)(CC)CC)O.[Br-]

Isomeric SMILES

CCCC(C(C1=CC=CC=C1)C(=O)OCC[N+](C)(CC)CC)O.[Br-]

InChI

InChI=1S/C19H32NO3.BrH/c1-5-11-17(21)18(16-12-9-8-10-13-16)19(22)23-15-14-20(4,6-2)7-3;/h8-10,12-13,17-18,21H,5-7,11,14-15H2,1-4H3;1H/q+1;/p-1