1-ethyl-6,8-bis(fluoranyl)-7-[4-(hydroxymethyl)imidazol-1-yl]-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 1-ethyl-6,8-bis(fluoranyl)-7-[4-(hydroxymethyl)imidazol-1-yl]-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-ethyl-6,8-difluoro-7-[4-(hydroxymethyl)imidazol-1-yl]-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-ethyl-6,8-difluoro-7-[4-(hydroxymethyl)-1-imidazolyl]-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-ethyl-6,8-difluoro-7-[4-(hydroxymethyl)imidazol-1-yl]-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-ethyl-6,8-difluoro-4-keto-7-(4-methylolimidazol-1-yl)quinoline-3-carboxylic acid Formula: C16H13F2N3O4 MolecularWeight: 349.288926

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=CC(=C(C(=C21)F)N3C=C(N=C3)CO)F)C(=O)O

Isomeric SMILES

CCN1C=C(C(=O)C2=CC(=C(C(=C21)F)N3C=C(N=C3)CO)F)C(=O)O

InChI

InChI=1S/C16H13F2N3O4/c1-2-20-5-10(16(24)25)15(23)9-3-11(17)14(12(18)13(9)20)21-4-8(6-22)19-7-21/h3-5,7,22H,2,6H2,1H3,(H,24,25)