2-[[1-ethyl-6-fluoranyl-4-oxidanylidene-2-(piperidin-4-ylamino)quinolin-3-yl]carbonylamino]ethanoic acid

Systemtic Name: 2-[[1-ethyl-6-fluoranyl-4-oxidanylidene-2-(piperidin-4-ylamino)quinolin-3-yl]carbonylamino]ethanoic acid Openeye Name: 2-[[1-ethyl-6-fluoro-4-oxo-2-(4-piperidylamino)quinoline-3-carbonyl]amino]acetic acid CAS Name: 2-[[[1-ethyl-6-fluoro-4-oxo-2-(4-piperidinylamino)-3-quinolinyl]-oxomethyl]amino]acetic acid IUPAC Name: 2-[[1-ethyl-6-fluoro-4-oxo-2-(piperidin-4-ylamino)quinoline-3-carbonyl]amino]acetic acid Traditional Name: 2-[[1-ethyl-6-fluoro-4-keto-2-(4-piperidylamino)quinoline-3-carbonyl]amino]acetic acid Formula: C19H23FN4O4 MolecularWeight: 390.408723

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)F)C(=O)C(=C1NC3CCNCC3)C(=O)NCC(=O)O

Isomeric SMILES

CCN1C2=C(C=C(C=C2)F)C(=O)C(=C1NC3CCNCC3)C(=O)NCC(=O)O

InChI

InChI=1S/C19H23FN4O4/c1-2-24-14-4-3-11(20)9-13(14)17(27)16(19(28)22-10-15(25)26)18(24)23-12-5-7-21-8-6-12/h3-4,9,12,21,23H,2,5-8,10H2,1H3,(H,22,28)(H,25,26)