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

Systemtic Name: ethyl 2-cyano-2-[3-cyano-1-cyclopropyl-6,8-bis(fluoranyl)-4-oxidanylidene-quinolin-7-yl]ethanoate Openeye Name: ethyl 2-cyano-2-(3-cyano-1-cyclopropyl-6,8-difluoro-4-oxo-7-quinolyl)acetate CAS Name: 2-cyano-2-(3-cyano-1-cyclopropyl-6,8-difluoro-4-oxo-7-quinolinyl)acetic acid ethyl ester IUPAC Name: ethyl 2-cyano-2-(3-cyano-1-cyclopropyl-6,8-difluoro-4-oxoquinolin-7-yl)acetate Traditional Name: 2-cyano-2-(3-cyano-1-cyclopropyl-6,8-difluoro-4-keto-7-quinolyl)acetic acid ethyl ester Formula: C18H13F2N3O3 MolecularWeight: 357.310926

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H13F2N3O3/c1-2-26-18(25)12(7-22)14-13(19)5-11-16(15(14)20)23(10-3-4-10)8-9(6-21)17(11)24/h5,8,10,12H,2-4H2,1H3