5-fluoranyl-1-[[2-fluoranyl-4-(1-propylpyrazol-4-yl)phenyl]methyl]-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 5-fluoranyl-1-[[2-fluoranyl-4-(1-propylpyrazol-4-yl)phenyl]methyl]-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 5-fluoro-1-[[2-fluoro-4-(1-propylpyrazol-4-yl)phenyl]methyl]-4-oxo-quinoline-3-carboxylic acid CAS Name: 5-fluoro-1-[[2-fluoro-4-(1-propyl-4-pyrazolyl)phenyl]methyl]-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 5-fluoro-1-[[2-fluoro-4-(1-propylpyrazol-4-yl)phenyl]methyl]-4-oxoquinoline-3-carboxylic acid Traditional Name: 5-fluoro-1-[2-fluoro-4-(1-propylpyrazol-4-yl)benzyl]-4-keto-quinoline-3-carboxylic acid Formula: C23H19F2N3O3 MolecularWeight: 423.412066

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C=C(C=N1)C2=CC(=C(C=C2)CN3C=C(C(=O)C4=C3C=CC=C4F)C(=O)O)F

Isomeric SMILES

CCCN1C=C(C=N1)C2=CC(=C(C=C2)CN3C=C(C(=O)C4=C3C=CC=C4F)C(=O)O)F

InChI

InChI=1S/C23H19F2N3O3/c1-2-8-28-12-16(10-26-28)14-6-7-15(19(25)9-14)11-27-13-17(23(30)31)22(29)21-18(24)4-3-5-20(21)27/h3-7,9-10,12-13H,2,8,11H2,1H3,(H,30,31)