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

Systemtic Name: ethyl 1-(6-azanyl-5-fluoranyl-3-methyl-pyridin-2-yl)-8-chloranyl-6,7-bis(fluoranyl)-4-oxidanylidene-quinoline-3-carboxylate Openeye Name: ethyl 1-(6-amino-5-fluoro-3-methyl-2-pyridyl)-8-chloro-6,7-difluoro-4-oxo-quinoline-3-carboxylate CAS Name: 1-(6-amino-5-fluoro-3-methyl-2-pyridinyl)-8-chloro-6,7-difluoro-4-oxo-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(6-amino-5-fluoro-3-methylpyridin-2-yl)-8-chloro-6,7-difluoro-4-oxoquinoline-3-carboxylate Traditional Name: 1-(6-amino-5-fluoro-3-methyl-2-pyridyl)-8-chloro-6,7-difluoro-4-keto-quinoline-3-carboxylic acid ethyl ester Formula: C18H13ClF3N3O3 MolecularWeight: 411.76233

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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=C3C)F)N

Isomeric SMILES

CCOC(=O)C1=CN(C2=C(C(=C(C=C2C1=O)F)F)Cl)C3=NC(=C(C=C3C)F)N

InChI

InChI=1S/C18H13ClF3N3O3/c1-3-28-18(27)9-6-25(17-7(2)4-11(21)16(23)24-17)14-8(15(9)26)5-10(20)13(22)12(14)19/h4-6H,3H2,1-2H3,(H2,23,24)