1,1-diethyl-6,8-bis(fluoranyl)-4-oxidanylidene-7-pyridin-2-yl-quinolin-1-ium-3-carboxylate

Systemtic Name: 1,1-diethyl-6,8-bis(fluoranyl)-4-oxidanylidene-7-pyridin-2-yl-quinolin-1-ium-3-carboxylate Openeye Name: 1,1-diethyl-6,8-difluoro-4-oxo-7-(2-pyridyl)quinolin-1-ium-3-carboxylate CAS Name: 1,1-diethyl-6,8-difluoro-4-oxo-7-(2-pyridinyl)-3-quinolin-1-iumcarboxylate IUPAC Name: 1,1-diethyl-6,8-difluoro-4-oxo-7-pyridin-2-ylquinolin-1-ium-3-carboxylate Traditional Name: 1,1-diethyl-6,8-difluoro-4-keto-7-(2-pyridyl)quinolin-1-ium-3-carboxylate Formula: C19H16F2N2O3 MolecularWeight: 358.338746

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1(C=C(C(=O)C2=CC(=C(C(=C21)F)C3=CC=CC=N3)F)C(=O)[O-])CC

Isomeric SMILES

CC[N+]1(C=C(C(=O)C2=CC(=C(C(=C21)F)C3=CC=CC=N3)F)C(=O)[O-])CC

InChI

InChI=1S/C19H16F2N2O3/c1-3-23(4-2)10-12(19(25)26)18(24)11-9-13(20)15(16(21)17(11)23)14-7-5-6-8-22-14/h5-10H,3-4H2,1-2H3