6-fluoranyl-1-(2-fluoranylethyl)-4-oxidanylidene-7-pyrrol-1-yl-quinoline-3-carboxylic acid

Systemtic Name: 6-fluoranyl-1-(2-fluoranylethyl)-4-oxidanylidene-7-pyrrol-1-yl-quinoline-3-carboxylic acid Openeye Name: 6-fluoro-1-(2-fluoroethyl)-4-oxo-7-pyrrol-1-yl-quinoline-3-carboxylic acid CAS Name: 6-fluoro-1-(2-fluoroethyl)-4-oxo-7-(1-pyrrolyl)-3-quinolinecarboxylic acid IUPAC Name: 6-fluoro-1-(2-fluoroethyl)-4-oxo-7-pyrrol-1-ylquinoline-3-carboxylic acid Traditional Name: 6-fluoro-1-(2-fluoroethyl)-4-keto-7-pyrrol-1-yl-quinoline-3-carboxylic acid Formula: C16H12F2N2O3 MolecularWeight: 318.274886

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(C=C1)C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)CCF)F

Isomeric SMILES

C1=CN(C=C1)C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)CCF)F

InChI

InChI=1S/C16H12F2N2O3/c17-3-6-20-9-11(16(22)23)15(21)10-7-12(18)14(8-13(10)20)19-4-1-2-5-19/h1-2,4-5,7-9H,3,6H2,(H,22,23)