ethyl 1-(4-azanyl-5-fluoranyl-pyridin-2-yl)-8-chloranyl-6,7-bis(fluoranyl)-4-oxidanylidene-quinoline-3-carboxylate

Systemtic Name: ethyl 1-(4-azanyl-5-fluoranyl-pyridin-2-yl)-8-chloranyl-6,7-bis(fluoranyl)-4-oxidanylidene-quinoline-3-carboxylate Openeye Name: ethyl 1-(4-amino-5-fluoro-2-pyridyl)-8-chloro-6,7-difluoro-4-oxo-quinoline-3-carboxylate CAS Name: 1-(4-amino-5-fluoro-2-pyridinyl)-8-chloro-6,7-difluoro-4-oxo-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(4-amino-5-fluoropyridin-2-yl)-8-chloro-6,7-difluoro-4-oxoquinoline-3-carboxylate Traditional Name: 1-(4-amino-5-fluoro-2-pyridyl)-8-chloro-6,7-difluoro-4-keto-quinoline-3-carboxylic acid ethyl ester Formula: C17H11ClF3N3O3 MolecularWeight: 397.73575

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN(C2=C(C(=C(C=C2C1=O)F)F)Cl)C3=NC=C(C(=C3)N)F

Isomeric SMILES

CCOC(=O)C1=CN(C2=C(C(=C(C=C2C1=O)F)F)Cl)C3=NC=C(C(=C3)N)F

InChI

InChI=1S/C17H11ClF3N3O3/c1-2-27-17(26)8-6-24(12-4-11(22)10(20)5-23-12)15-7(16(8)25)3-9(19)14(21)13(15)18/h3-6H,2H2,1H3,(H2,22,23)