1-ethyl-6-fluoranyl-7-[1-(2-hydroxyethyl)pyrazol-3-yl]-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 1-ethyl-6-fluoranyl-7-[1-(2-hydroxyethyl)pyrazol-3-yl]-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-ethyl-6-fluoro-7-[1-(2-hydroxyethyl)pyrazol-3-yl]-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-ethyl-6-fluoro-7-[1-(2-hydroxyethyl)-3-pyrazolyl]-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-ethyl-6-fluoro-7-[1-(2-hydroxyethyl)pyrazol-3-yl]-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-ethyl-6-fluoro-7-[1-(2-hydroxyethyl)pyrazol-3-yl]-4-keto-quinoline-3-carboxylic acid Formula: C17H16FN3O4 MolecularWeight: 345.325043

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=CC(=C(C=C21)C3=NN(C=C3)CCO)F)C(=O)O

Isomeric SMILES

CCN1C=C(C(=O)C2=CC(=C(C=C21)C3=NN(C=C3)CCO)F)C(=O)O

InChI

InChI=1S/C17H16FN3O4/c1-2-20-9-12(17(24)25)16(23)11-7-13(18)10(8-15(11)20)14-3-4-21(19-14)5-6-22/h3-4,7-9,22H,2,5-6H2,1H3,(H,24,25)