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

Systemtic Name: 4-oxidanylidene-4-[1-(2-phenethylphenoxy)-3-pyrrolidin-1-yl-propan-2-yl]oxy-butanoic acid Openeye Name: 4-oxo-4-[1-[(2-phenethylphenoxy)methyl]-2-pyrrolidin-1-yl-ethoxy]butanoic acid CAS Name: 4-oxo-4-[1-(2-phenethylphenoxy)-3-(1-pyrrolidinyl)propan-2-yl]oxybutanoic acid IUPAC Name: 4-oxo-4-[1-(2-phenethylphenoxy)-3-pyrrolidin-1-ylpropan-2-yl]oxybutanoic acid Traditional Name: 4-keto-4-[1-[(2-phenethylphenoxy)methyl]-2-pyrrolidino-ethoxy]butyric acid Formula: C25H31NO5 MolecularWeight: 425.51734

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC(COC2=CC=CC=C2CCC3=CC=CC=C3)OC(=O)CCC(=O)O

Isomeric SMILES

C1CCN(C1)CC(COC2=CC=CC=C2CCC3=CC=CC=C3)OC(=O)CCC(=O)O

InChI

InChI=1S/C25H31NO5/c27-24(28)14-15-25(29)31-22(18-26-16-6-7-17-26)19-30-23-11-5-4-10-21(23)13-12-20-8-2-1-3-9-20/h1-5,8-11,22H,6-7,12-19H2,(H,27,28)