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

Systemtic Name: 1-(6-azanyl-5-fluoranyl-pyridin-2-yl)-8-bromanyl-6,7-bis(fluoranyl)-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-(6-amino-5-fluoro-2-pyridyl)-8-bromo-6,7-difluoro-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-(6-amino-5-fluoro-2-pyridinyl)-8-bromo-6,7-difluoro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-(6-amino-5-fluoropyridin-2-yl)-8-bromo-6,7-difluoro-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-(6-amino-5-fluoro-2-pyridyl)-8-bromo-6,7-difluoro-4-keto-quinoline-3-carboxylic acid Formula: C15H7BrF3N3O3 MolecularWeight: 414.13359

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=NC(=C1F)N)N2C=C(C(=O)C3=CC(=C(C(=C32)Br)F)F)C(=O)O

Isomeric SMILES

C1=CC(=NC(=C1F)N)N2C=C(C(=O)C3=CC(=C(C(=C32)Br)F)F)C(=O)O

InChI

InChI=1S/C15H7BrF3N3O3/c16-10-11(19)8(18)3-5-12(10)22(4-6(13(5)23)15(24)25)9-2-1-7(17)14(20)21-9/h1-4H,(H2,20,21)(H,24,25)