3-(4-phenylpiperidin-1-yl)propyl 2-cyclopentyl-2-oxidanyl-2-phenyl-ethanoate hydrochloride

Systemtic Name: 3-(4-phenylpiperidin-1-yl)propyl 2-cyclopentyl-2-oxidanyl-2-phenyl-ethanoate hydrochloride Openeye Name: 3-(4-phenyl-1-piperidyl)propyl 2-cyclopentyl-2-hydroxy-2-phenyl-acetate hydrochloride CAS Name: 2-cyclopentyl-2-hydroxy-2-phenylacetic acid 3-(4-phenyl-1-piperidinyl)propyl ester hydrochloride IUPAC Name: 3-(4-phenylpiperidin-1-yl)propyl 2-cyclopentyl-2-hydroxy-2-phenylacetate hydrochloride Traditional Name: 2-cyclopentyl-2-hydroxy-2-phenyl-acetic acid 3-(4-phenylpiperidino)propyl ester hydrochloride Formula: C27H36ClNO3 MolecularWeight: 458.03264

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)C(C2=CC=CC=C2)(C(=O)OCCCN3CCC(CC3)C4=CC=CC=C4)O.Cl

Isomeric SMILES

C1CCC(C1)C(C2=CC=CC=C2)(C(=O)OCCCN3CCC(CC3)C4=CC=CC=C4)O.Cl

InChI

InChI=1S/C27H35NO3.ClH/c29-26(27(30,25-14-7-8-15-25)24-12-5-2-6-13-24)31-21-9-18-28-19-16-23(17-20-28)22-10-3-1-4-11-22;/h1-6,10-13,23,25,30H,7-9,14-21H2;1H