1-cyclopentyl-1-phenyl-5-pyrrolidin-1-ium-1-yl-pent-3-yn-1-ol chloride

Systemtic Name: 1-cyclopentyl-1-phenyl-5-pyrrolidin-1-ium-1-yl-pent-3-yn-1-ol chloride Openeye Name: 1-cyclopentyl-1-phenyl-5-pyrrolidin-1-ium-1-yl-pent-3-yn-1-ol chloride CAS Name: 1-cyclopentyl-1-phenyl-5-(1-pyrrolidin-1-iumyl)-3-pentyn-1-ol chloride IUPAC Name: 1-cyclopentyl-1-phenyl-5-pyrrolidin-1-ium-1-ylpent-3-yn-1-ol chloride Traditional Name: 1-cyclopentyl-1-phenyl-5-pyrrolidin-1-ium-1-yl-pent-3-yn-1-ol chloride Formula: C20H28ClNO MolecularWeight: 333.89542

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)C(CC#CC[NH+]2CCCC2)(C3=CC=CC=C3)O.[Cl-]

Isomeric SMILES

C1CCC(C1)C(CC#CC[NH+]2CCCC2)(C3=CC=CC=C3)O.[Cl-]

InChI

InChI=1S/C20H27NO.ClH/c22-20(19-12-4-5-13-19,18-10-2-1-3-11-18)14-6-7-15-21-16-8-9-17-21;/h1-3,10-11,19,22H,4-5,8-9,12-17H2;1H