(2-bromophenyl)methyl-dimethyl-(3-naphthalen-2-yloxy-2-oxidanyl-propyl)azanium bromide

Systemtic Name: (2-bromophenyl)methyl-dimethyl-(3-naphthalen-2-yloxy-2-oxidanyl-propyl)azanium bromide Openeye Name: (2-bromophenyl)methyl-[2-hydroxy-3-(2-naphthyloxy)propyl]-dimethyl-ammonium bromide CAS Name: (2-bromophenyl)methyl-[2-hydroxy-3-(2-naphthalenyloxy)propyl]-dimethylammonium bromide IUPAC Name: (2-bromophenyl)methyl-(2-hydroxy-3-naphthalen-2-yloxypropyl)-dimethylazanium bromide Traditional Name: (2-bromobenzyl)-[2-hydroxy-3-(2-naphthoxy)propyl]-dimethyl-ammonium bromide Formula: C22H25Br2NO2 MolecularWeight: 495.2474

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(CC1=CC=CC=C1Br)CC(COC2=CC3=CC=CC=C3C=C2)O.[Br-]

Isomeric SMILES

C[N+](C)(CC1=CC=CC=C1Br)CC(COC2=CC3=CC=CC=C3C=C2)O.[Br-]

InChI

InChI=1S/C22H25BrNO2.BrH/c1-24(2,14-19-9-5-6-10-22(19)23)15-20(25)16-26-21-12-11-17-7-3-4-8-18(17)13-21;/h3-13,20,25H,14-16H2,1-2H3;1H/q+1;/p-1