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

Systemtic Name: cyanomethyl 2-[3-carboxyoxy-1-cyclopropyl-6,8-bis(fluoranyl)-4-oxidanylidene-quinolin-7-yl]ethanoate Openeye Name: cyanomethyl 2-(3-carboxyoxy-1-cyclopropyl-6,8-difluoro-4-oxo-7-quinolyl)acetate CAS Name: 2-(3-carboxyoxy-1-cyclopropyl-6,8-difluoro-4-oxo-7-quinolinyl)acetic acid cyanomethyl ester IUPAC Name: cyanomethyl 2-(3-carboxyoxy-1-cyclopropyl-6,8-difluoro-4-oxoquinolin-7-yl)acetate Traditional Name: 2-(3-carboxyoxy-1-cyclopropyl-6,8-difluoro-4-keto-7-quinolyl)acetic acid cyanomethyl ester Formula: C17H12F2N2O6 MolecularWeight: 378.283786

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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)OC(=O)O

Isomeric SMILES

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

InChI

InChI=1S/C17H12F2N2O6/c18-11-5-10-15(14(19)9(11)6-13(22)26-4-3-20)21(8-1-2-8)7-12(16(10)23)27-17(24)25/h5,7-8H,1-2,4,6H2,(H,24,25)