[1-(3-carboxy-1-cyclopropyl-6-fluoranyl-4-oxidanylidene-quinolin-7-yl)azetidin-3-yl]-ethyl-dimethyl-azanium iodide

Systemtic Name: [1-(3-carboxy-1-cyclopropyl-6-fluoranyl-4-oxidanylidene-quinolin-7-yl)azetidin-3-yl]-ethyl-dimethyl-azanium iodide Openeye Name: [1-(3-carboxy-1-cyclopropyl-6-fluoro-4-oxo-7-quinolyl)azetidin-3-yl]-ethyl-dimethyl-ammonium iodide CAS Name: [1-(3-carboxy-1-cyclopropyl-6-fluoro-4-oxo-7-quinolinyl)-3-azetidinyl]-ethyl-dimethylammonium iodide IUPAC Name: [1-(3-carboxy-1-cyclopropyl-6-fluoro-4-oxoquinolin-7-yl)azetidin-3-yl]-ethyl-dimethylazanium iodide Traditional Name: [1-(3-carboxy-1-cyclopropyl-6-fluoro-4-keto-7-quinolyl)azetidin-3-yl]-ethyl-dimethyl-ammonium iodide Formula: C20H25FIN3O3 MolecularWeight: 501.333673

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+](C)(C)C1CN(C1)C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)C4CC4)F.[I-]

Isomeric SMILES

CC[N+](C)(C)C1CN(C1)C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)C4CC4)F.[I-]

InChI

InChI=1S/C20H24FN3O3.HI/c1-4-24(2,3)13-9-22(10-13)18-8-17-14(7-16(18)21)19(25)15(20(26)27)11-23(17)12-5-6-12;/h7-8,11-13H,4-6,9-10H2,1-3H3;1H