benzoic acid; 3-[2-(4-phenylbutyl)piperidin-1-yl]propan-1-ol; hydrochloride

Systemtic Name: benzoic acid; 3-[2-(4-phenylbutyl)piperidin-1-yl]propan-1-ol; hydrochloride Openeye Name: benzoic acid; 3-[2-(4-phenylbutyl)-1-piperidyl]propan-1-ol; hydrochloride CAS Name: benzoic acid; 3-[2-(4-phenylbutyl)-1-piperidinyl]-1-propanol; hydrochloride IUPAC Name: benzoic acid; 3-[2-(4-phenylbutyl)piperidin-1-yl]propan-1-ol; hydrochloride Traditional Name: benzoic acid; 3-[2-(4-phenylbutyl)piperidino]propan-1-ol; hydrochloride Formula: C25H36ClNO3 MolecularWeight: 434.01124

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)CCCCC2=CC=CC=C2)CCCO.C1=CC=C(C=C1)C(=O)O.Cl

Isomeric SMILES

C1CCN(C(C1)CCCCC2=CC=CC=C2)CCCO.C1=CC=C(C=C1)C(=O)O.Cl

InChI

InChI=1S/C18H29NO.C7H6O2.ClH/c20-16-8-15-19-14-7-6-13-18(19)12-5-4-11-17-9-2-1-3-10-17;8-7(9)6-4-2-1-3-5-6;/h1-3,9-10,18,20H,4-8,11-16H2;1-5H,(H,8,9);1H