4-[1-(2-phenethylphenoxy)-3-piperidin-1-yl-propan-2-yl]oxybutanoic acid

Systemtic Name: 4-[1-(2-phenethylphenoxy)-3-piperidin-1-yl-propan-2-yl]oxybutanoic acid Openeye Name: 4-[1-[(2-phenethylphenoxy)methyl]-2-(1-piperidyl)ethoxy]butanoic acid CAS Name: 4-[1-(2-phenethylphenoxy)-3-(1-piperidinyl)propan-2-yl]oxybutanoic acid IUPAC Name: 4-[1-(2-phenethylphenoxy)-3-piperidin-1-ylpropan-2-yl]oxybutanoic acid Traditional Name: 4-[1-[(2-phenethylphenoxy)methyl]-2-piperidino-ethoxy]butyric acid Formula: C26H35NO4 MolecularWeight: 425.5604

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC(COC2=CC=CC=C2CCC3=CC=CC=C3)OCCCC(=O)O

Isomeric SMILES

C1CCN(CC1)CC(COC2=CC=CC=C2CCC3=CC=CC=C3)OCCCC(=O)O

InChI

InChI=1S/C26H35NO4/c28-26(29)14-9-19-30-24(20-27-17-7-2-8-18-27)21-31-25-13-6-5-12-23(25)16-15-22-10-3-1-4-11-22/h1,3-6,10-13,24H,2,7-9,14-21H2,(H,28,29)