dimethyl-[3-(3-methylsulfonylphenyl)propyl]-(2-oxidanyl-2-phenyl-ethyl)azanium

Systemtic Name: dimethyl-[3-(3-methylsulfonylphenyl)propyl]-(2-oxidanyl-2-phenyl-ethyl)azanium Openeye Name: (2-hydroxy-2-phenyl-ethyl)-dimethyl-[3-(3-methylsulfonylphenyl)propyl]ammonium CAS Name: (2-hydroxy-2-phenylethyl)-dimethyl-[3-(3-methylsulfonylphenyl)propyl]ammonium IUPAC Name: (2-hydroxy-2-phenylethyl)-dimethyl-[3-(3-methylsulfonylphenyl)propyl]azanium Traditional Name: (2-hydroxy-2-phenyl-ethyl)-[3-(3-mesylphenyl)propyl]-dimethyl-ammonium Formula: C20H28NO3S+ MolecularWeight: 362.50622

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(CCCC1=CC(=CC=C1)S(=O)(=O)C)CC(C2=CC=CC=C2)O

Isomeric SMILES

C[N+](C)(CCCC1=CC(=CC=C1)S(=O)(=O)C)CC(C2=CC=CC=C2)O

InChI

InChI=1S/C20H28NO3S/c1-21(2,16-20(22)18-11-5-4-6-12-18)14-8-10-17-9-7-13-19(15-17)25(3,23)24/h4-7,9,11-13,15,20,22H,8,10,14,16H2,1-3H3/q+1