1-[6-azanyl-3,5-bis(fluoranyl)pyridin-2-yl]-8-chloranyl-6-fluoranyl-7-(2-methoxyethylamino)-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 1-[6-azanyl-3,5-bis(fluoranyl)pyridin-2-yl]-8-chloranyl-6-fluoranyl-7-(2-methoxyethylamino)-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-(6-amino-3,5-difluoro-2-pyridyl)-8-chloro-6-fluoro-7-(2-methoxyethylamino)-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-(6-amino-3,5-difluoro-2-pyridinyl)-8-chloro-6-fluoro-7-(2-methoxyethylamino)-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-(6-amino-3,5-difluoropyridin-2-yl)-8-chloro-6-fluoro-7-(2-methoxyethylamino)-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-(6-amino-3,5-difluoro-2-pyridyl)-8-chloro-6-fluoro-4-keto-7-(2-methoxyethylamino)quinoline-3-carboxylic acid Formula: C18H14ClF3N4O4 MolecularWeight: 442.77637

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Descriptors Computed from Structure

Canonical SMILES:

COCCNC1=C(C=C2C(=C1Cl)N(C=C(C2=O)C(=O)O)C3=NC(=C(C=C3F)F)N)F

Isomeric SMILES

COCCNC1=C(C=C2C(=C1Cl)N(C=C(C2=O)C(=O)O)C3=NC(=C(C=C3F)F)N)F

InChI

InChI=1S/C18H14ClF3N4O4/c1-30-3-2-24-13-9(20)4-7-14(12(13)19)26(6-8(15(7)27)18(28)29)17-11(22)5-10(21)16(23)25-17/h4-6,24H,2-3H2,1H3,(H2,23,25)(H,28,29)