3-[2-oxidanylidene-3-(4-propan-2-ylphenoxy)pyrrolidin-1-yl]benzoic acid

Systemtic Name: 3-[2-oxidanylidene-3-(4-propan-2-ylphenoxy)pyrrolidin-1-yl]benzoic acid Openeye Name: 3-[3-(4-isopropylphenoxy)-2-oxo-pyrrolidin-1-yl]benzoic acid CAS Name: 3-[2-oxo-3-(4-propan-2-ylphenoxy)-1-pyrrolidinyl]benzoic acid IUPAC Name: 3-[2-oxo-3-(4-propan-2-ylphenoxy)pyrrolidin-1-yl]benzoic acid Traditional Name: 3-[3-(4-isopropylphenoxy)-2-keto-pyrrolidino]benzoic acid Formula: C20H21NO4 MolecularWeight: 339.38504

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)OC2CCN(C2=O)C3=CC=CC(=C3)C(=O)O

Isomeric SMILES

CC(C)C1=CC=C(C=C1)OC2CCN(C2=O)C3=CC=CC(=C3)C(=O)O

InChI

InChI=1S/C20H21NO4/c1-13(2)14-6-8-17(9-7-14)25-18-10-11-21(19(18)22)16-5-3-4-15(12-16)20(23)24/h3-9,12-13,18H,10-11H2,1-2H3,(H,23,24)