1-[1-(phenylmethyl)piperidin-3-yl]ethyl benzoate hydrochloride

Systemtic Name: 1-[1-(phenylmethyl)piperidin-3-yl]ethyl benzoate hydrochloride Openeye Name: 1-(1-benzyl-3-piperidyl)ethyl benzoate hydrochloride CAS Name: benzoic acid 1-[1-(phenylmethyl)-3-piperidinyl]ethyl ester hydrochloride IUPAC Name: 1-(1-benzylpiperidin-3-yl)ethyl benzoate hydrochloride Traditional Name: benzoic acid 1-(1-benzyl-3-piperidyl)ethyl ester hydrochloride Formula: C21H26ClNO2 MolecularWeight: 359.88964

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1CCCN(C1)CC2=CC=CC=C2)OC(=O)C3=CC=CC=C3.Cl

Isomeric SMILES

CC(C1CCCN(C1)CC2=CC=CC=C2)OC(=O)C3=CC=CC=C3.Cl

InChI

InChI=1S/C21H25NO2.ClH/c1-17(24-21(23)19-11-6-3-7-12-19)20-13-8-14-22(16-20)15-18-9-4-2-5-10-18;/h2-7,9-12,17,20H,8,13-16H2,1H3;1H