4-[2-[4-[(4-methylphenyl)methyl]piperidin-1-ium-1-yl]ethoxy]phenol chloride

Systemtic Name: 4-[2-[4-[(4-methylphenyl)methyl]piperidin-1-ium-1-yl]ethoxy]phenol chloride Openeye Name: 4-[2-[4-(p-tolylmethyl)piperidin-1-ium-1-yl]ethoxy]phenol chloride CAS Name: 4-[2-[4-[(4-methylphenyl)methyl]-1-piperidin-1-iumyl]ethoxy]phenol chloride IUPAC Name: 4-[2-[4-[(4-methylphenyl)methyl]piperidin-1-ium-1-yl]ethoxy]phenol chloride Traditional Name: 4-[2-[4-(4-methylbenzyl)piperidin-1-ium-1-yl]ethoxy]phenol chloride Formula: C21H28ClNO2 MolecularWeight: 361.90552

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CC2CC[NH+](CC2)CCOC3=CC=C(C=C3)O.[Cl-]

Isomeric SMILES

CC1=CC=C(C=C1)CC2CC[NH+](CC2)CCOC3=CC=C(C=C3)O.[Cl-]

InChI

InChI=1S/C21H27NO2.ClH/c1-17-2-4-18(5-3-17)16-19-10-12-22(13-11-19)14-15-24-21-8-6-20(23)7-9-21;/h2-9,19,23H,10-16H2,1H3;1H