1-cyclopropyl-6-fluoranyl-4-oxidanylidene-7-(2,3,6-trimethylpyridin-4-yl)quinoline-3-carboxylic acid

Systemtic Name: 1-cyclopropyl-6-fluoranyl-4-oxidanylidene-7-(2,3,6-trimethylpyridin-4-yl)quinoline-3-carboxylic acid Openeye Name: 1-cyclopropyl-6-fluoro-4-oxo-7-(2,3,6-trimethyl-4-pyridyl)quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-6-fluoro-4-oxo-7-(2,3,6-trimethyl-4-pyridinyl)-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-6-fluoro-4-oxo-7-(2,3,6-trimethylpyridin-4-yl)quinoline-3-carboxylic acid Traditional Name: 1-cyclopropyl-6-fluoro-4-keto-7-(2,3,6-trimethyl-4-pyridyl)quinoline-3-carboxylic acid Formula: C21H19FN2O3 MolecularWeight: 366.385563

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C(=C1)C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)C4CC4)F)C)C

Isomeric SMILES

CC1=NC(=C(C(=C1)C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)C4CC4)F)C)C

InChI

InChI=1S/C21H19FN2O3/c1-10-6-14(11(2)12(3)23-10)15-8-19-16(7-18(15)22)20(25)17(21(26)27)9-24(19)13-4-5-13/h6-9,13H,4-5H2,1-3H3,(H,26,27)