diethyl 2-[3-cyano-1-cyclopropyl-6,8-bis(fluoranyl)-4-oxidanylidene-quinolin-7-yl]propanedioate

Systemtic Name: diethyl 2-[3-cyano-1-cyclopropyl-6,8-bis(fluoranyl)-4-oxidanylidene-quinolin-7-yl]propanedioate Openeye Name: diethyl 2-(3-cyano-1-cyclopropyl-6,8-difluoro-4-oxo-7-quinolyl)propanedioate CAS Name: 2-(3-cyano-1-cyclopropyl-6,8-difluoro-4-oxo-7-quinolinyl)propanedioic acid diethyl ester IUPAC Name: diethyl 2-(3-cyano-1-cyclopropyl-6,8-difluoro-4-oxoquinolin-7-yl)propanedioate Traditional Name: 2-(3-cyano-1-cyclopropyl-6,8-difluoro-4-keto-7-quinolyl)malonic acid diethyl ester Formula: C20H18F2N2O5 MolecularWeight: 404.364126

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1=C(C=C2C(=C1F)N(C=C(C2=O)C#N)C3CC3)F)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(C1=C(C=C2C(=C1F)N(C=C(C2=O)C#N)C3CC3)F)C(=O)OCC

InChI

InChI=1S/C20H18F2N2O5/c1-3-28-19(26)15(20(27)29-4-2)14-13(21)7-12-17(16(14)22)24(11-5-6-11)9-10(8-23)18(12)25/h7,9,11,15H,3-6H2,1-2H3