[4,4-bis(4-fluorophenyl)-2-oxidanyl-butyl]-but-3-enyl-dimethyl-azanium hydroxide

Systemtic Name: [4,4-bis(4-fluorophenyl)-2-oxidanyl-butyl]-but-3-enyl-dimethyl-azanium hydroxide Openeye Name: [4,4-bis(4-fluorophenyl)-2-hydroxy-butyl]-but-3-enyl-dimethyl-ammonium hydroxide CAS Name: [4,4-bis(4-fluorophenyl)-2-hydroxybutyl]-but-3-enyl-dimethylammonium hydroxide IUPAC Name: [4,4-bis(4-fluorophenyl)-2-hydroxybutyl]-but-3-enyl-dimethylazanium hydroxide Traditional Name: [4,4-bis(4-fluorophenyl)-2-hydroxy-butyl]-but-3-enyl-dimethyl-ammonium hydroxide Formula: C22H29F2NO2 MolecularWeight: 377.467966

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(CCC=C)CC(CC(C1=CC=C(C=C1)F)C2=CC=C(C=C2)F)O.[OH-]

Isomeric SMILES

C[N+](C)(CCC=C)CC(CC(C1=CC=C(C=C1)F)C2=CC=C(C=C2)F)O.[OH-]

InChI

InChI=1S/C22H28F2NO.H2O/c1-4-5-14-25(2,3)16-21(26)15-22(17-6-10-19(23)11-7-17)18-8-12-20(24)13-9-18;/h4,6-13,21-22,26H,1,5,14-16H2,2-3H3;1H2/q+1;/p-1