[1-(phenylmethyl)piperidin-4-yl] 3-(dimethylamino)benzoate hydrochloride

Systemtic Name: [1-(phenylmethyl)piperidin-4-yl] 3-(dimethylamino)benzoate hydrochloride Openeye Name: (1-benzyl-4-piperidyl) 3-(dimethylamino)benzoate hydrochloride CAS Name: 3-(dimethylamino)benzoic acid [1-(phenylmethyl)-4-piperidinyl] ester hydrochloride IUPAC Name: (1-benzylpiperidin-4-yl) 3-(dimethylamino)benzoate hydrochloride Traditional Name: 3-(dimethylamino)benzoic acid (1-benzyl-4-piperidyl) ester hydrochloride Formula: C21H27ClN2O2 MolecularWeight: 374.90428

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=CC(=C1)C(=O)OC2CCN(CC2)CC3=CC=CC=C3.Cl

Isomeric SMILES

CN(C)C1=CC=CC(=C1)C(=O)OC2CCN(CC2)CC3=CC=CC=C3.Cl

InChI

InChI=1S/C21H26N2O2.ClH/c1-22(2)19-10-6-9-18(15-19)21(24)25-20-11-13-23(14-12-20)16-17-7-4-3-5-8-17;/h3-10,15,20H,11-14,16H2,1-2H3;1H