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

Systemtic Name: cyanomethyl 2-[3-cyano-1-cyclopropyl-6,8-bis(fluoranyl)-4-oxidanylidene-quinolin-7-yl]ethanoate Openeye Name: cyanomethyl 2-(3-cyano-1-cyclopropyl-6,8-difluoro-4-oxo-7-quinolyl)acetate CAS Name: 2-(3-cyano-1-cyclopropyl-6,8-difluoro-4-oxo-7-quinolinyl)acetic acid cyanomethyl ester IUPAC Name: cyanomethyl 2-(3-cyano-1-cyclopropyl-6,8-difluoro-4-oxoquinolin-7-yl)acetate Traditional Name: 2-(3-cyano-1-cyclopropyl-6,8-difluoro-4-keto-7-quinolyl)acetic acid cyanomethyl ester Formula: C17H11F2N3O3 MolecularWeight: 343.284346

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C=C(C(=O)C3=CC(=C(C(=C32)F)CC(=O)OCC#N)F)C#N

Isomeric SMILES

C1CC1N2C=C(C(=O)C3=CC(=C(C(=C32)F)CC(=O)OCC#N)F)C#N

InChI

InChI=1S/C17H11F2N3O3/c18-13-5-12-16(15(19)11(13)6-14(23)25-4-3-20)22(10-1-2-10)8-9(7-21)17(12)24/h5,8,10H,1-2,4,6H2