4-[[5-oxidanylidene-1-(4-propan-2-yloxyphenyl)pyrrolidin-3-yl]methoxy]benzoic acid

Systemtic Name: 4-[[5-oxidanylidene-1-(4-propan-2-yloxyphenyl)pyrrolidin-3-yl]methoxy]benzoic acid Openeye Name: 4-[[1-(4-isopropoxyphenyl)-5-oxo-pyrrolidin-3-yl]methoxy]benzoic acid CAS Name: 4-[[5-oxo-1-(4-propan-2-yloxyphenyl)-3-pyrrolidinyl]methoxy]benzoic acid IUPAC Name: 4-[[5-oxo-1-(4-propan-2-yloxyphenyl)pyrrolidin-3-yl]methoxy]benzoic acid Traditional Name: 4-[[1-(4-isopropoxyphenyl)-5-keto-pyrrolidin-3-yl]methoxy]benzoic acid Formula: C21H23NO5 MolecularWeight: 369.41102

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)N2CC(CC2=O)COC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)N2CC(CC2=O)COC3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C21H23NO5/c1-14(2)27-19-9-5-17(6-10-19)22-12-15(11-20(22)23)13-26-18-7-3-16(4-8-18)21(24)25/h3-10,14-15H,11-13H2,1-2H3,(H,24,25)