7-(3-azanylazetidin-1-yl)-1-(4-azanyl-5-fluoranyl-pyridin-2-yl)-8-chloranyl-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 7-(3-azanylazetidin-1-yl)-1-(4-azanyl-5-fluoranyl-pyridin-2-yl)-8-chloranyl-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-(3-aminoazetidin-1-yl)-1-(4-amino-5-fluoro-2-pyridyl)-8-chloro-6-fluoro-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-(3-amino-1-azetidinyl)-1-(4-amino-5-fluoro-2-pyridinyl)-8-chloro-6-fluoro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-(3-aminoazetidin-1-yl)-1-(4-amino-5-fluoropyridin-2-yl)-8-chloro-6-fluoro-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-(3-aminoazetidin-1-yl)-1-(4-amino-5-fluoro-2-pyridyl)-8-chloro-6-fluoro-4-keto-quinoline-3-carboxylic acid Formula: C18H14ClF2N5O3 MolecularWeight: 421.785266

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(CN1C2=C(C=C3C(=C2Cl)N(C=C(C3=O)C(=O)O)C4=NC=C(C(=C4)N)F)F)N

Isomeric SMILES

C1C(CN1C2=C(C=C3C(=C2Cl)N(C=C(C3=O)C(=O)O)C4=NC=C(C(=C4)N)F)F)N

InChI

InChI=1S/C18H14ClF2N5O3/c19-14-15-8(1-10(20)16(14)25-4-7(22)5-25)17(27)9(18(28)29)6-26(15)13-2-12(23)11(21)3-24-13/h1-3,6-7H,4-5,22H2,(H2,23,24)(H,28,29)