1-[(4-chlorophenyl)methoxy]-3-[1-(phenylmethyl)piperidin-1-ium-1-yl]propan-2-ol

Systemtic Name: 1-[(4-chlorophenyl)methoxy]-3-[1-(phenylmethyl)piperidin-1-ium-1-yl]propan-2-ol Openeye Name: 1-(1-benzylpiperidin-1-ium-1-yl)-3-[(4-chlorophenyl)methoxy]propan-2-ol CAS Name: 1-[(4-chlorophenyl)methoxy]-3-[1-(phenylmethyl)-1-piperidin-1-iumyl]-2-propanol IUPAC Name: 1-(1-benzylpiperidin-1-ium-1-yl)-3-[(4-chlorophenyl)methoxy]propan-2-ol Traditional Name: 1-(1-benzylpiperidin-1-ium-1-yl)-3-(4-chlorobenzyl)oxy-propan-2-ol Formula: C22H29ClNO2+ MolecularWeight: 374.92416

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[N+](CC1)(CC2=CC=CC=C2)CC(COCC3=CC=C(C=C3)Cl)O

Isomeric SMILES

C1CC[N+](CC1)(CC2=CC=CC=C2)CC(COCC3=CC=C(C=C3)Cl)O

InChI

InChI=1S/C22H29ClNO2/c23-21-11-9-20(10-12-21)17-26-18-22(25)16-24(13-5-2-6-14-24)15-19-7-3-1-4-8-19/h1,3-4,7-12,22,25H,2,5-6,13-18H2/q+1