4-[2-[4-(phenylmethyl)piperidin-1-ium-1-yl]ethyl]phenol chloride

Systemtic Name: 4-[2-[4-(phenylmethyl)piperidin-1-ium-1-yl]ethyl]phenol chloride Openeye Name: 4-[2-(4-benzylpiperidin-1-ium-1-yl)ethyl]phenol chloride CAS Name: 4-[2-[4-(phenylmethyl)-1-piperidin-1-iumyl]ethyl]phenol chloride IUPAC Name: 4-[2-(4-benzylpiperidin-1-ium-1-yl)ethyl]phenol chloride Traditional Name: 4-[2-(4-benzylpiperidin-1-ium-1-yl)ethyl]phenol chloride Formula: C20H26ClNO MolecularWeight: 331.87954

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1CC2=CC=CC=C2)CCC3=CC=C(C=C3)O.[Cl-]

Isomeric SMILES

C1C[NH+](CCC1CC2=CC=CC=C2)CCC3=CC=C(C=C3)O.[Cl-]

InChI

InChI=1S/C20H25NO.ClH/c22-20-8-6-17(7-9-20)10-13-21-14-11-19(12-15-21)16-18-4-2-1-3-5-18;/h1-9,19,22H,10-16H2;1H