3-[4-[3-(naphthalen-2-ylmethoxy)piperidin-4-yl]phenoxy]propyl benzoate hydrochloride

Systemtic Name: 3-[4-[3-(naphthalen-2-ylmethoxy)piperidin-4-yl]phenoxy]propyl benzoate hydrochloride Openeye Name: 3-[4-[3-(2-naphthylmethoxy)-4-piperidyl]phenoxy]propyl benzoate hydrochloride CAS Name: benzoic acid 3-[4-[3-(2-naphthalenylmethoxy)-4-piperidinyl]phenoxy]propyl ester hydrochloride IUPAC Name: 3-[4-[3-(naphthalen-2-ylmethoxy)piperidin-4-yl]phenoxy]propyl benzoate hydrochloride Traditional Name: benzoic acid 3-[4-[3-(2-naphthylmethoxy)-4-piperidyl]phenoxy]propyl ester hydrochloride Formula: C32H34ClNO4 MolecularWeight: 532.06966

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCC(C1C2=CC=C(C=C2)OCCCOC(=O)C3=CC=CC=C3)OCC4=CC5=CC=CC=C5C=C4.Cl

Isomeric SMILES

C1CNCC(C1C2=CC=C(C=C2)OCCCOC(=O)C3=CC=CC=C3)OCC4=CC5=CC=CC=C5C=C4.Cl

InChI

InChI=1S/C32H33NO4.ClH/c34-32(27-8-2-1-3-9-27)36-20-6-19-35-29-15-13-26(14-16-29)30-17-18-33-22-31(30)37-23-24-11-12-25-7-4-5-10-28(25)21-24;/h1-5,7-16,21,30-31,33H,6,17-20,22-23H2;1H