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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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