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

Systemtic Name: 5-[3,4-bis(fluoranyl)pyridin-2-yl]-8-chloranyl-6-fluoranyl-4-oxidanylidene-7-(pyrrolidin-3-ylamino)-1H-quinoline-3-carboxylic acid Openeye Name: 8-chloro-5-(3,4-difluoro-2-pyridyl)-6-fluoro-4-oxo-7-(pyrrolidin-3-ylamino)-1H-quinoline-3-carboxylic acid CAS Name: 8-chloro-5-(3,4-difluoro-2-pyridinyl)-6-fluoro-4-oxo-7-(3-pyrrolidinylamino)-1H-quinoline-3-carboxylic acid IUPAC Name: 8-chloro-5-(3,4-difluoropyridin-2-yl)-6-fluoro-4-oxo-7-(pyrrolidin-3-ylamino)-1H-quinoline-3-carboxylic acid Traditional Name: 8-chloro-5-(3,4-difluoro-2-pyridyl)-6-fluoro-4-keto-7-(pyrrolidin-3-ylamino)-1H-quinoline-3-carboxylic acid Formula: C19H14ClF3N4O3 MolecularWeight: 438.78767

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCC1NC2=C(C(=C3C(=C2Cl)NC=C(C3=O)C(=O)O)C4=NC=CC(=C4F)F)F

Isomeric SMILES

C1CNCC1NC2=C(C(=C3C(=C2Cl)NC=C(C3=O)C(=O)O)C4=NC=CC(=C4F)F)F

InChI

InChI=1S/C19H14ClF3N4O3/c20-12-15-11(18(28)8(6-26-15)19(29)30)10(16-13(22)9(21)2-4-25-16)14(23)17(12)27-7-1-3-24-5-7/h2,4,6-7,24,27H,1,3,5H2,(H,26,28)(H,29,30)