1-(6-azanyl-5-fluoranyl-pyridin-2-yl)-8-bromanyl-6-fluoranyl-7-[3-(methylamino)azetidin-1-yl]-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 1-(6-azanyl-5-fluoranyl-pyridin-2-yl)-8-bromanyl-6-fluoranyl-7-[3-(methylamino)azetidin-1-yl]-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-(6-amino-5-fluoro-2-pyridyl)-8-bromo-6-fluoro-7-[3-(methylamino)azetidin-1-yl]-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-(6-amino-5-fluoro-2-pyridinyl)-8-bromo-6-fluoro-7-[3-(methylamino)-1-azetidinyl]-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-(6-amino-5-fluoropyridin-2-yl)-8-bromo-6-fluoro-7-[3-(methylamino)azetidin-1-yl]-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-(6-amino-5-fluoro-2-pyridyl)-8-bromo-6-fluoro-4-keto-7-[3-(methylamino)azetidin-1-yl]quinoline-3-carboxylic acid Formula: C19H16BrF2N5O3 MolecularWeight: 480.262846

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Descriptors Computed from Structure

Canonical SMILES:

CNC1CN(C1)C2=C(C=C3C(=C2Br)N(C=C(C3=O)C(=O)O)C4=NC(=C(C=C4)F)N)F

Isomeric SMILES

CNC1CN(C1)C2=C(C=C3C(=C2Br)N(C=C(C3=O)C(=O)O)C4=NC(=C(C=C4)F)N)F

InChI

InChI=1S/C19H16BrF2N5O3/c1-24-8-5-26(6-8)16-12(22)4-9-15(14(16)20)27(7-10(17(9)28)19(29)30)13-3-2-11(21)18(23)25-13/h2-4,7-8,24H,5-6H2,1H3,(H2,23,25)(H,29,30)