1-(4-tert-butylphenoxy)-3-(4-methylpiperidin-1-ium-1-yl)propan-2-ol chloride

Systemtic Name: 1-(4-tert-butylphenoxy)-3-(4-methylpiperidin-1-ium-1-yl)propan-2-ol chloride Openeye Name: 1-(4-tert-butylphenoxy)-3-(4-methylpiperidin-1-ium-1-yl)propan-2-ol chloride CAS Name: 1-(4-tert-butylphenoxy)-3-(4-methyl-1-piperidin-1-iumyl)-2-propanol chloride IUPAC Name: 1-(4-tert-butylphenoxy)-3-(4-methylpiperidin-1-ium-1-yl)propan-2-ol chloride Traditional Name: 1-(4-tert-butylphenoxy)-3-(4-methylpiperidin-1-ium-1-yl)propan-2-ol chloride Formula: C19H32ClNO2 MolecularWeight: 341.91588

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)CC(COC2=CC=C(C=C2)C(C)(C)C)O.[Cl-]

Isomeric SMILES

CC1CC[NH+](CC1)CC(COC2=CC=C(C=C2)C(C)(C)C)O.[Cl-]

InChI

InChI=1S/C19H31NO2.ClH/c1-15-9-11-20(12-10-15)13-17(21)14-22-18-7-5-16(6-8-18)19(2,3)4;/h5-8,15,17,21H,9-14H2,1-4H3;1H