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

Systemtic Name: 4-[1-(4-methylpiperidin-1-yl)-3-(2-phenethylphenoxy)propan-2-yl]oxybutanoic acid Openeye Name: 4-[1-[(4-methyl-1-piperidyl)methyl]-2-(2-phenethylphenoxy)ethoxy]butanoic acid CAS Name: 4-[1-(4-methyl-1-piperidinyl)-3-(2-phenethylphenoxy)propan-2-yl]oxybutanoic acid IUPAC Name: 4-[1-(4-methylpiperidin-1-yl)-3-(2-phenethylphenoxy)propan-2-yl]oxybutanoic acid Traditional Name: 4-[1-[(4-methylpiperidino)methyl]-2-(2-phenethylphenoxy)ethoxy]butyric acid Formula: C27H37NO4 MolecularWeight: 439.58698

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)CC(COC2=CC=CC=C2CCC3=CC=CC=C3)OCCCC(=O)O

Isomeric SMILES

CC1CCN(CC1)CC(COC2=CC=CC=C2CCC3=CC=CC=C3)OCCCC(=O)O

InChI

InChI=1S/C27H37NO4/c1-22-15-17-28(18-16-22)20-25(31-19-7-12-27(29)30)21-32-26-11-6-5-10-24(26)14-13-23-8-3-2-4-9-23/h2-6,8-11,22,25H,7,12-21H2,1H3,(H,29,30)