[[3-[(7-fluoranylquinolin-2-yl)methoxy]phenyl]amino] 2,2-diethyl-3-methyl-4-oxidanylidene-butanoate

Systemtic Name: [[3-[(7-fluoranylquinolin-2-yl)methoxy]phenyl]amino] 2,2-diethyl-3-methyl-4-oxidanylidene-butanoate Openeye Name: [3-[(7-fluoro-2-quinolyl)methoxy]anilino] 2,2-diethyl-3-methyl-4-oxo-butanoate CAS Name: 2,2-diethyl-3-methyl-4-oxobutanoic acid [3-[(7-fluoro-2-quinolinyl)methoxy]anilino] ester IUPAC Name: [3-[(7-fluoroquinolin-2-yl)methoxy]anilino] 2,2-diethyl-3-methyl-4-oxobutanoate Traditional Name: 2,2-diethyl-4-keto-3-methyl-butyric acid [3-[(7-fluoro-2-quinolyl)methoxy]anilino] ester Formula: C25H27FN2O4 MolecularWeight: 438.491283

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(C(C)C=O)C(=O)ONC1=CC(=CC=C1)OCC2=NC3=C(C=CC(=C3)F)C=C2

Isomeric SMILES

CCC(CC)(C(C)C=O)C(=O)ONC1=CC(=CC=C1)OCC2=NC3=C(C=CC(=C3)F)C=C2

InChI

InChI=1S/C25H27FN2O4/c1-4-25(5-2,17(3)15-29)24(30)32-28-20-7-6-8-22(14-20)31-16-21-12-10-18-9-11-19(26)13-23(18)27-21/h6-15,17,28H,4-5,16H2,1-3H3