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

Systemtic Name: 2-ethyl-4-[[3-[(7-fluoranylquinolin-2-yl)methoxy]phenyl]amino]-2-methyl-4-oxidanylidene-butanoic acid Openeye Name: 2-ethyl-4-[3-[(7-fluoro-2-quinolyl)methoxy]anilino]-2-methyl-4-oxo-butanoic acid CAS Name: 2-ethyl-4-[3-[(7-fluoro-2-quinolinyl)methoxy]anilino]-2-methyl-4-oxobutanoic acid IUPAC Name: 2-ethyl-4-[3-[(7-fluoroquinolin-2-yl)methoxy]anilino]-2-methyl-4-oxobutanoic acid Traditional Name: 2-ethyl-4-[3-[(7-fluoro-2-quinolyl)methoxy]anilino]-4-keto-2-methyl-butyric acid Formula: C23H23FN2O4 MolecularWeight: 410.438123

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H23FN2O4/c1-3-23(2,22(28)29)13-21(27)26-17-5-4-6-19(12-17)30-14-18-10-8-15-7-9-16(24)11-20(15)25-18/h4-12H,3,13-14H2,1-2H3,(H,26,27)(H,28,29)