(2-bromophenyl)methyl-dimethyl-(3-naphthalen-1-yloxy-2-oxidanyl-propyl)azanium bromide

Systemtic Name: (2-bromophenyl)methyl-dimethyl-(3-naphthalen-1-yloxy-2-oxidanyl-propyl)azanium bromide Openeye Name: (2-bromophenyl)methyl-[2-hydroxy-3-(1-naphthyloxy)propyl]-dimethyl-ammonium bromide CAS Name: (2-bromophenyl)methyl-[2-hydroxy-3-(1-naphthalenyloxy)propyl]-dimethylammonium bromide IUPAC Name: (2-bromophenyl)methyl-(2-hydroxy-3-naphthalen-1-yloxypropyl)-dimethylazanium bromide Traditional Name: (2-bromobenzyl)-[2-hydroxy-3-(1-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=CC=CC3=CC=CC=C32)O.[Br-]

Isomeric SMILES

C[N+](C)(CC1=CC=CC=C1Br)CC(COC2=CC=CC3=CC=CC=C32)O.[Br-]

InChI

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