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

Systemtic Name: 4-[[5-oxidanylidene-1-(4-propylphenyl)pyrrolidin-3-yl]methoxy]benzoic acid Openeye Name: 4-[[5-oxo-1-(4-propylphenyl)pyrrolidin-3-yl]methoxy]benzoic acid CAS Name: 4-[[5-oxo-1-(4-propylphenyl)-3-pyrrolidinyl]methoxy]benzoic acid IUPAC Name: 4-[[5-oxo-1-(4-propylphenyl)pyrrolidin-3-yl]methoxy]benzoic acid Traditional Name: 4-[[5-keto-1-(4-propylphenyl)pyrrolidin-3-yl]methoxy]benzoic acid Formula: C21H23NO4 MolecularWeight: 353.41162

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)N2CC(CC2=O)COC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CCCC1=CC=C(C=C1)N2CC(CC2=O)COC3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C21H23NO4/c1-2-3-15-4-8-18(9-5-15)22-13-16(12-20(22)23)14-26-19-10-6-17(7-11-19)21(24)25/h4-11,16H,2-3,12-14H2,1H3,(H,24,25)