1-(1-methylcyclopentyl)-1-phenyl-4-(1-propylpiperidin-1-ium-1-yl)but-2-yn-1-ol bromide

Systemtic Name: 1-(1-methylcyclopentyl)-1-phenyl-4-(1-propylpiperidin-1-ium-1-yl)but-2-yn-1-ol bromide Openeye Name: 1-(1-methylcyclopentyl)-1-phenyl-4-(1-propylpiperidin-1-ium-1-yl)but-2-yn-1-ol bromide CAS Name: 1-(1-methylcyclopentyl)-1-phenyl-4-(1-propyl-1-piperidin-1-iumyl)-2-butyn-1-ol bromide IUPAC Name: 1-(1-methylcyclopentyl)-1-phenyl-4-(1-propylpiperidin-1-ium-1-yl)but-2-yn-1-ol bromide Traditional Name: 1-(1-methylcyclopentyl)-1-phenyl-4-(1-propylpiperidin-1-ium-1-yl)but-2-yn-1-ol bromide Formula: C24H36BrNO MolecularWeight: 434.45274

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Descriptors Computed from Structure

Canonical SMILES:

CCC[N+]1(CCCCC1)CC#CC(C2=CC=CC=C2)(C3(CCCC3)C)O.[Br-]

Isomeric SMILES

CCC[N+]1(CCCCC1)CC#CC(C2=CC=CC=C2)(C3(CCCC3)C)O.[Br-]

InChI

InChI=1S/C24H36NO.BrH/c1-3-18-25(19-10-5-11-20-25)21-12-17-24(26,22-13-6-4-7-14-22)23(2)15-8-9-16-23;/h4,6-7,13-14,26H,3,5,8-11,15-16,18-21H2,1-2H3;1H/q+1;/p-1