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

Systemtic Name: 4-[1-(4-aminocarbonylpiperidin-1-yl)-3-(2-phenethylphenoxy)propan-2-yl]oxy-4-oxidanylidene-butanoic acid hydrochloride Openeye Name: 4-[1-[(4-carbamoyl-1-piperidyl)methyl]-2-(2-phenethylphenoxy)ethoxy]-4-oxo-butanoic acid hydrochloride CAS Name: 4-[1-(4-carbamoyl-1-piperidinyl)-3-(2-phenethylphenoxy)propan-2-yl]oxy-4-oxobutanoic acid hydrochloride IUPAC Name: 4-[1-(4-carbamoylpiperidin-1-yl)-3-(2-phenethylphenoxy)propan-2-yl]oxy-4-oxobutanoic acid hydrochloride Traditional Name: 4-[1-[(4-carbamoylpiperidino)methyl]-2-(2-phenethylphenoxy)ethoxy]-4-keto-butyric acid hydrochloride Formula: C27H35ClN2O6 MolecularWeight: 519.0296

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N)CC(COC2=CC=CC=C2CCC3=CC=CC=C3)OC(=O)CCC(=O)O.Cl

Isomeric SMILES

C1CN(CCC1C(=O)N)CC(COC2=CC=CC=C2CCC3=CC=CC=C3)OC(=O)CCC(=O)O.Cl

InChI

InChI=1S/C27H34N2O6.ClH/c28-27(33)22-14-16-29(17-15-22)18-23(35-26(32)13-12-25(30)31)19-34-24-9-5-4-8-21(24)11-10-20-6-2-1-3-7-20;/h1-9,22-23H,10-19H2,(H2,28,33)(H,30,31);1H