3-(4-azoniabicyclo[4.2.1]nonan-4-yl)-1-cyclohexyl-1-phenyl-propan-1-ol chloride

Systemtic Name: 3-(4-azoniabicyclo[4.2.1]nonan-4-yl)-1-cyclohexyl-1-phenyl-propan-1-ol chloride Openeye Name: 3-(4-azoniabicyclo[4.2.1]nonan-4-yl)-1-cyclohexyl-1-phenyl-propan-1-ol chloride CAS Name: 3-(4-azoniabicyclo[4.2.1]nonan-4-yl)-1-cyclohexyl-1-phenyl-1-propanol chloride IUPAC Name: 3-(4-azoniabicyclo[4.2.1]nonan-4-yl)-1-cyclohexyl-1-phenylpropan-1-ol chloride Traditional Name: 3-(4-azoniabicyclo[4.2.1]nonan-4-yl)-1-cyclohexyl-1-phenyl-propan-1-ol chloride Formula: C23H36ClNO MolecularWeight: 377.99104

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(CC[NH+]2CCC3CCC(C3)C2)(C4=CC=CC=C4)O.[Cl-]

Isomeric SMILES

C1CCC(CC1)C(CC[NH+]2CCC3CCC(C3)C2)(C4=CC=CC=C4)O.[Cl-]

InChI

InChI=1S/C23H35NO.ClH/c25-23(21-7-3-1-4-8-21,22-9-5-2-6-10-22)14-16-24-15-13-19-11-12-20(17-19)18-24;/h1,3-4,7-8,19-20,22,25H,2,5-6,9-18H2;1H