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

Systemtic Name: 2-methoxy-3-[5-oxidanylidene-1-(4-propylphenyl)pyrrolidin-3-yl]benzoic acid Openeye Name: 2-methoxy-3-[5-oxo-1-(4-propylphenyl)pyrrolidin-3-yl]benzoic acid CAS Name: 2-methoxy-3-[5-oxo-1-(4-propylphenyl)-3-pyrrolidinyl]benzoic acid IUPAC Name: 2-methoxy-3-[5-oxo-1-(4-propylphenyl)pyrrolidin-3-yl]benzoic acid Traditional Name: 3-[5-keto-1-(4-propylphenyl)pyrrolidin-3-yl]-2-methoxy-benzoic acid Formula: C21H23NO4 MolecularWeight: 353.41162

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)N2CC(CC2=O)C3=CC=CC(=C3OC)C(=O)O

Isomeric SMILES

CCCC1=CC=C(C=C1)N2CC(CC2=O)C3=CC=CC(=C3OC)C(=O)O

InChI

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