[4-(3-fluorophenyl)-4-oxidanyl-4-phenyl-but-2-ynyl]-bis(2-hydroxyethyl)azanium chloride

Systemtic Name: [4-(3-fluorophenyl)-4-oxidanyl-4-phenyl-but-2-ynyl]-bis(2-hydroxyethyl)azanium chloride Openeye Name: [4-(3-fluorophenyl)-4-hydroxy-4-phenyl-but-2-ynyl]-bis(2-hydroxyethyl)ammonium chloride CAS Name: [4-(3-fluorophenyl)-4-hydroxy-4-phenylbut-2-ynyl]-bis(2-hydroxyethyl)ammonium chloride IUPAC Name: [4-(3-fluorophenyl)-4-hydroxy-4-phenylbut-2-ynyl]-bis(2-hydroxyethyl)azanium chloride Traditional Name: [4-(3-fluorophenyl)-4-hydroxy-4-phenyl-but-2-ynyl]-bis(2-hydroxyethyl)ammonium chloride Formula: C20H23ClFNO3 MolecularWeight: 379.852923

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C#CC[NH+](CCO)CCO)(C2=CC(=CC=C2)F)O.[Cl-]

Isomeric SMILES

C1=CC=C(C=C1)C(C#CC[NH+](CCO)CCO)(C2=CC(=CC=C2)F)O.[Cl-]

InChI

InChI=1S/C20H22FNO3.ClH/c21-19-9-4-8-18(16-19)20(25,17-6-2-1-3-7-17)10-5-11-22(12-14-23)13-15-24;/h1-4,6-9,16,23-25H,11-15H2;1H