3-(1,2,5-trimethyl-4-propyl-piperidin-1-ium-1-yl)phenol chloride

Systemtic Name: 3-(1,2,5-trimethyl-4-propyl-piperidin-1-ium-1-yl)phenol chloride Openeye Name: 3-(1,2,5-trimethyl-4-propyl-piperidin-1-ium-1-yl)phenol chloride CAS Name: 3-(1,2,5-trimethyl-4-propyl-1-piperidin-1-iumyl)phenol chloride IUPAC Name: 3-(1,2,5-trimethyl-4-propylpiperidin-1-ium-1-yl)phenol chloride Traditional Name: 3-(1,2,5-trimethyl-4-propyl-piperidin-1-ium-1-yl)phenol chloride Formula: C17H28ClNO MolecularWeight: 297.86332

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1CC([N+](CC1C)(C)C2=CC(=CC=C2)O)C.[Cl-]

Isomeric SMILES

CCCC1CC([N+](CC1C)(C)C2=CC(=CC=C2)O)C.[Cl-]

InChI

InChI=1S/C17H27NO.ClH/c1-5-7-15-10-14(3)18(4,12-13(15)2)16-8-6-9-17(19)11-16;/h6,8-9,11,13-15H,5,7,10,12H2,1-4H3;1H