5,8-bis(fluoranyl)-1-[(2-imidazol-1-ylpyridin-4-yl)methyl]-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 5,8-bis(fluoranyl)-1-[(2-imidazol-1-ylpyridin-4-yl)methyl]-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 5,8-difluoro-1-[(2-imidazol-1-yl-4-pyridyl)methyl]-4-oxo-quinoline-3-carboxylic acid CAS Name: 5,8-difluoro-1-[[2-(1-imidazolyl)-4-pyridinyl]methyl]-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 5,8-difluoro-1-[(2-imidazol-1-ylpyridin-4-yl)methyl]-4-oxoquinoline-3-carboxylic acid Traditional Name: 5,8-difluoro-1-[(2-imidazol-1-yl-4-pyridyl)methyl]-4-keto-quinoline-3-carboxylic acid Formula: C19H12F2N4O3 MolecularWeight: 382.320386

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C2C(=C1F)C(=O)C(=CN2CC3=CC(=NC=C3)N4C=CN=C4)C(=O)O)F

Isomeric SMILES

C1=CC(=C2C(=C1F)C(=O)C(=CN2CC3=CC(=NC=C3)N4C=CN=C4)C(=O)O)F

InChI

InChI=1S/C19H12F2N4O3/c20-13-1-2-14(21)17-16(13)18(26)12(19(27)28)9-25(17)8-11-3-4-23-15(7-11)24-6-5-22-10-24/h1-7,9-10H,8H2,(H,27,28)