benzoic acid; 2-(2-phenethylpiperidin-1-yl)ethanol; hydrochloride

Systemtic Name: benzoic acid; 2-(2-phenethylpiperidin-1-yl)ethanol; hydrochloride Openeye Name: benzoic acid; 2-(2-phenethyl-1-piperidyl)ethanol; hydrochloride CAS Name: benzoic acid; 2-(2-phenethyl-1-piperidinyl)ethanol; hydrochloride IUPAC Name: benzoic acid; 2-(2-phenethylpiperidin-1-yl)ethanol; hydrochloride Traditional Name: benzoic acid; 2-(2-phenethylpiperidino)ethanol; hydrochloride Formula: C22H30ClNO3 MolecularWeight: 391.9315

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)CCC2=CC=CC=C2)CCO.C1=CC=C(C=C1)C(=O)O.Cl

Isomeric SMILES

C1CCN(C(C1)CCC2=CC=CC=C2)CCO.C1=CC=C(C=C1)C(=O)O.Cl

InChI

InChI=1S/C15H23NO.C7H6O2.ClH/c17-13-12-16-11-5-4-8-15(16)10-9-14-6-2-1-3-7-14;8-7(9)6-4-2-1-3-5-6;/h1-3,6-7,15,17H,4-5,8-13H2;1-5H,(H,8,9);1H