6-fluoranyl-1-(2-fluoranylethyl)-2-heptan-3-yl-8-methoxy-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 6-fluoranyl-1-(2-fluoranylethyl)-2-heptan-3-yl-8-methoxy-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 2-(1-ethylpentyl)-6-fluoro-1-(2-fluoroethyl)-8-methoxy-4-oxo-quinoline-3-carboxylic acid CAS Name: 6-fluoro-1-(2-fluoroethyl)-2-heptan-3-yl-8-methoxy-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 6-fluoro-1-(2-fluoroethyl)-2-heptan-3-yl-8-methoxy-4-oxoquinoline-3-carboxylic acid Traditional Name: 2-(1-ethylpentyl)-6-fluoro-1-(2-fluoroethyl)-4-keto-8-methoxy-quinoline-3-carboxylic acid Formula: C20H25F2NO4 MolecularWeight: 381.413606

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C1=C(C(=O)C2=CC(=CC(=C2N1CCF)OC)F)C(=O)O

Isomeric SMILES

CCCCC(CC)C1=C(C(=O)C2=CC(=CC(=C2N1CCF)OC)F)C(=O)O

InChI

InChI=1S/C20H25F2NO4/c1-4-6-7-12(5-2)17-16(20(25)26)19(24)14-10-13(22)11-15(27-3)18(14)23(17)9-8-21/h10-12H,4-9H2,1-3H3,(H,25,26)