4-oxidanylidene-4-[1-(2-phenethylphenoxy)-3-piperidin-1-yl-propan-2-yl]oxy-butanoic acid hydrochloride

Systemtic Name: 4-oxidanylidene-4-[1-(2-phenethylphenoxy)-3-piperidin-1-yl-propan-2-yl]oxy-butanoic acid hydrochloride Openeye Name: 4-oxo-4-[1-[(2-phenethylphenoxy)methyl]-2-(1-piperidyl)ethoxy]butanoic acid hydrochloride CAS Name: 4-oxo-4-[1-(2-phenethylphenoxy)-3-(1-piperidinyl)propan-2-yl]oxybutanoic acid hydrochloride IUPAC Name: 4-oxo-4-[1-(2-phenethylphenoxy)-3-piperidin-1-ylpropan-2-yl]oxybutanoic acid hydrochloride Traditional Name: 4-keto-4-[1-[(2-phenethylphenoxy)methyl]-2-piperidino-ethoxy]butyric acid hydrochloride Formula: C26H34ClNO5 MolecularWeight: 476.00486

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC(COC2=CC=CC=C2CCC3=CC=CC=C3)OC(=O)CCC(=O)O.Cl

Isomeric SMILES

C1CCN(CC1)CC(COC2=CC=CC=C2CCC3=CC=CC=C3)OC(=O)CCC(=O)O.Cl

InChI

InChI=1S/C26H33NO5.ClH/c28-25(29)15-16-26(30)32-23(19-27-17-7-2-8-18-27)20-31-24-12-6-5-11-22(24)14-13-21-9-3-1-4-10-21;/h1,3-6,9-12,23H,2,7-8,13-20H2,(H,28,29);1H