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

Systemtic Name: 7-(3-azanylazetidin-1-yl)-1-(6-azanyl-5-fluoranyl-pyridin-2-yl)-8-bromanyl-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-(3-aminoazetidin-1-yl)-1-(6-amino-5-fluoro-2-pyridyl)-8-bromo-6-fluoro-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-(3-amino-1-azetidinyl)-1-(6-amino-5-fluoro-2-pyridinyl)-8-bromo-6-fluoro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-(3-aminoazetidin-1-yl)-1-(6-amino-5-fluoropyridin-2-yl)-8-bromo-6-fluoro-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-(3-aminoazetidin-1-yl)-1-(6-amino-5-fluoro-2-pyridyl)-8-bromo-6-fluoro-4-keto-quinoline-3-carboxylic acid Formula: C18H14BrF2N5O3 MolecularWeight: 466.236266

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN1C2=C(C=C3C(=C2Br)N(C=C(C3=O)C(=O)O)C4=NC(=C(C=C4)F)N)F)N

Isomeric SMILES

C1C(CN1C2=C(C=C3C(=C2Br)N(C=C(C3=O)C(=O)O)C4=NC(=C(C=C4)F)N)F)N

InChI

InChI=1S/C18H14BrF2N5O3/c19-13-14-8(3-11(21)15(13)25-4-7(22)5-25)16(27)9(18(28)29)6-26(14)12-2-1-10(20)17(23)24-12/h1-3,6-7H,4-5,22H2,(H2,23,24)(H,28,29)