(2-methyl-1-phenyl-3-piperidin-1-yl-propyl) benzoate hydrochloride

Systemtic Name: (2-methyl-1-phenyl-3-piperidin-1-yl-propyl) benzoate hydrochloride Openeye Name: [2-methyl-1-phenyl-3-(1-piperidyl)propyl] benzoate hydrochloride CAS Name: benzoic acid [2-methyl-1-phenyl-3-(1-piperidinyl)propyl] ester hydrochloride IUPAC Name: (2-methyl-1-phenyl-3-piperidin-1-ylpropyl) benzoate hydrochloride Traditional Name: benzoic acid (2-methyl-1-phenyl-3-piperidino-propyl) ester hydrochloride Formula: C22H28ClNO2 MolecularWeight: 373.91622

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN1CCCCC1)C(C2=CC=CC=C2)OC(=O)C3=CC=CC=C3.Cl

Isomeric SMILES

CC(CN1CCCCC1)C(C2=CC=CC=C2)OC(=O)C3=CC=CC=C3.Cl

InChI

InChI=1S/C22H27NO2.ClH/c1-18(17-23-15-9-4-10-16-23)21(19-11-5-2-6-12-19)25-22(24)20-13-7-3-8-14-20;/h2-3,5-8,11-14,18,21H,4,9-10,15-17H2,1H3;1H