6,8-bis(fluoranyl)-1-(1-fluoranylcyclopropyl)-2-heptan-3-yl-5-methyl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 6,8-bis(fluoranyl)-1-(1-fluoranylcyclopropyl)-2-heptan-3-yl-5-methyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 2-(1-ethylpentyl)-6,8-difluoro-1-(1-fluorocyclopropyl)-5-methyl-4-oxo-quinoline-3-carboxylic acid CAS Name: 6,8-difluoro-1-(1-fluorocyclopropyl)-2-heptan-3-yl-5-methyl-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 6,8-difluoro-1-(1-fluorocyclopropyl)-2-heptan-3-yl-5-methyl-4-oxoquinoline-3-carboxylic acid Traditional Name: 2-(1-ethylpentyl)-6,8-difluoro-1-(1-fluorocyclopropyl)-4-keto-5-methyl-quinoline-3-carboxylic acid Formula: C21H24F3NO3 MolecularWeight: 395.41537

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C1=C(C(=O)C2=C(C(=CC(=C2N1C3(CC3)F)F)F)C)C(=O)O

Isomeric SMILES

CCCCC(CC)C1=C(C(=O)C2=C(C(=CC(=C2N1C3(CC3)F)F)F)C)C(=O)O

InChI

InChI=1S/C21H24F3NO3/c1-4-6-7-12(5-2)17-16(20(27)28)19(26)15-11(3)13(22)10-14(23)18(15)25(17)21(24)8-9-21/h10,12H,4-9H2,1-3H3,(H,27,28)