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

Systemtic Name: 5-[bis(fluoranyl)methyl]-2-(4-methyl-5-oxidanylidene-imidazol-2-yl)quinoline-3-carboxylic acid Openeye Name: 5-(difluoromethyl)-2-(4-methyl-5-oxo-imidazol-2-yl)quinoline-3-carboxylic acid CAS Name: 5-(difluoromethyl)-2-(4-methyl-5-oxo-2-imidazolyl)-3-quinolinecarboxylic acid IUPAC Name: 5-(difluoromethyl)-2-(4-methyl-5-oxoimidazol-2-yl)quinoline-3-carboxylic acid Traditional Name: 5-(difluoromethyl)-2-(4-keto-5-methyl-imidazol-2-yl)quinoline-3-carboxylic acid Formula: C15H9F2N3O3 MolecularWeight: 317.247066

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC1=O)C2=NC3=CC=CC(=C3C=C2C(=O)O)C(F)F

Isomeric SMILES

CC1=NC(=NC1=O)C2=NC3=CC=CC(=C3C=C2C(=O)O)C(F)F

InChI

InChI=1S/C15H9F2N3O3/c1-6-14(21)20-13(18-6)11-9(15(22)23)5-8-7(12(16)17)3-2-4-10(8)19-11/h2-5,12H,1H3,(H,22,23)