4-[[5-oxidanylidene-1-(4-phenylmethoxyphenyl)pyrrolidin-3-yl]methoxy]benzoic acid

Systemtic Name: 4-[[5-oxidanylidene-1-(4-phenylmethoxyphenyl)pyrrolidin-3-yl]methoxy]benzoic acid Openeye Name: 4-[[1-(4-benzyloxyphenyl)-5-oxo-pyrrolidin-3-yl]methoxy]benzoic acid CAS Name: 4-[[5-oxo-1-(4-phenylmethoxyphenyl)-3-pyrrolidinyl]methoxy]benzoic acid IUPAC Name: 4-[[5-oxo-1-(4-phenylmethoxyphenyl)pyrrolidin-3-yl]methoxy]benzoic acid Traditional Name: 4-[[1-(4-benzoxyphenyl)-5-keto-pyrrolidin-3-yl]methoxy]benzoic acid Formula: C25H23NO5 MolecularWeight: 417.45382

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C1=O)C2=CC=C(C=C2)OCC3=CC=CC=C3)COC4=CC=C(C=C4)C(=O)O

Isomeric SMILES

C1C(CN(C1=O)C2=CC=C(C=C2)OCC3=CC=CC=C3)COC4=CC=C(C=C4)C(=O)O

InChI

InChI=1S/C25H23NO5/c27-24-14-19(17-31-22-10-6-20(7-11-22)25(28)29)15-26(24)21-8-12-23(13-9-21)30-16-18-4-2-1-3-5-18/h1-13,19H,14-17H2,(H,28,29)