(2-bromophenyl)-dimethyl-[(2-oxidanyl-2-phenethyl-cyclohexyl)methyl]azanium

Systemtic Name: (2-bromophenyl)-dimethyl-[(2-oxidanyl-2-phenethyl-cyclohexyl)methyl]azanium Openeye Name: (2-bromophenyl)-[(2-hydroxy-2-phenethyl-cyclohexyl)methyl]-dimethyl-ammonium CAS Name: (2-bromophenyl)-[(2-hydroxy-2-phenethylcyclohexyl)methyl]-dimethylammonium IUPAC Name: (2-bromophenyl)-[(2-hydroxy-2-phenethylcyclohexyl)methyl]-dimethylazanium Traditional Name: (2-bromophenyl)-[(2-hydroxy-2-phenethyl-cyclohexyl)methyl]-dimethyl-ammonium Formula: C23H31BrNO+ MolecularWeight: 417.40234

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(CC1CCCCC1(CCC2=CC=CC=C2)O)C3=CC=CC=C3Br

Isomeric SMILES

C[N+](C)(CC1CCCCC1(CCC2=CC=CC=C2)O)C3=CC=CC=C3Br

InChI

InChI=1S/C23H31BrNO/c1-25(2,22-14-7-6-13-21(22)24)18-20-12-8-9-16-23(20,26)17-15-19-10-4-3-5-11-19/h3-7,10-11,13-14,20,26H,8-9,12,15-18H2,1-2H3/q+1