(4-bromophenyl)-dimethyl-(2-oxidanyl-3-phenoxy-propyl)azanium

Systemtic Name: (4-bromophenyl)-dimethyl-(2-oxidanyl-3-phenoxy-propyl)azanium Openeye Name: (4-bromophenyl)-(2-hydroxy-3-phenoxy-propyl)-dimethyl-ammonium CAS Name: (4-bromophenyl)-(2-hydroxy-3-phenoxypropyl)-dimethylammonium IUPAC Name: (4-bromophenyl)-(2-hydroxy-3-phenoxypropyl)-dimethylazanium Traditional Name: (4-bromophenyl)-(2-hydroxy-3-phenoxy-propyl)-dimethyl-ammonium Formula: C17H21BrNO2+ MolecularWeight: 351.25814

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(CC(COC1=CC=CC=C1)O)C2=CC=C(C=C2)Br

Isomeric SMILES

C[N+](C)(CC(COC1=CC=CC=C1)O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C17H21BrNO2/c1-19(2,15-10-8-14(18)9-11-15)12-16(20)13-21-17-6-4-3-5-7-17/h3-11,16,20H,12-13H2,1-2H3/q+1