4-[[3-[(7-fluoranylquinolin-2-yl)methoxy]phenyl]amino]-2,2-dimethyl-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[[3-[(7-fluoranylquinolin-2-yl)methoxy]phenyl]amino]-2,2-dimethyl-4-oxidanylidene-butanoic acid Openeye Name: 4-[3-[(7-fluoro-2-quinolyl)methoxy]anilino]-2,2-dimethyl-4-oxo-butanoic acid CAS Name: 4-[3-[(7-fluoro-2-quinolinyl)methoxy]anilino]-2,2-dimethyl-4-oxobutanoic acid IUPAC Name: 4-[3-[(7-fluoroquinolin-2-yl)methoxy]anilino]-2,2-dimethyl-4-oxobutanoic acid Traditional Name: 4-[3-[(7-fluoro-2-quinolyl)methoxy]anilino]-4-keto-2,2-dimethyl-butyric acid Formula: C22H21FN2O4 MolecularWeight: 396.411543

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC(=O)NC1=CC(=CC=C1)OCC2=NC3=C(C=CC(=C3)F)C=C2)C(=O)O

Isomeric SMILES

CC(C)(CC(=O)NC1=CC(=CC=C1)OCC2=NC3=C(C=CC(=C3)F)C=C2)C(=O)O

InChI

InChI=1S/C22H21FN2O4/c1-22(2,21(27)28)12-20(26)25-16-4-3-5-18(11-16)29-13-17-9-7-14-6-8-15(23)10-19(14)24-17/h3-11H,12-13H2,1-2H3,(H,25,26)(H,27,28)