2-hydroxyethyl-dimethyl-(1-phenoxydodecyl)azanium bromide

Systemtic Name: 2-hydroxyethyl-dimethyl-(1-phenoxydodecyl)azanium bromide Openeye Name: 2-hydroxyethyl-dimethyl-(1-phenoxydodecyl)ammonium bromide CAS Name: 2-hydroxyethyl-dimethyl-(1-phenoxydodecyl)ammonium bromide IUPAC Name: 2-hydroxyethyl-dimethyl-(1-phenoxydodecyl)azanium bromide Traditional Name: 2-hydroxyethyl-dimethyl-(1-phenoxydodecyl)ammonium bromide Formula: C22H40BrNO2 MolecularWeight: 430.4625

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC([N+](C)(C)CCO)OC1=CC=CC=C1.[Br-]

Isomeric SMILES

CCCCCCCCCCCC([N+](C)(C)CCO)OC1=CC=CC=C1.[Br-]

InChI

InChI=1S/C22H40NO2.BrH/c1-4-5-6-7-8-9-10-11-15-18-22(23(2,3)19-20-24)25-21-16-13-12-14-17-21;/h12-14,16-17,22,24H,4-11,15,18-20H2,1-3H3;1H/q+1;/p-1