7-(3-azanyl-3-methyl-azetidin-1-yl)-1-ethyl-6,8-bis(fluoranyl)-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 7-(3-azanyl-3-methyl-azetidin-1-yl)-1-ethyl-6,8-bis(fluoranyl)-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-(3-amino-3-methyl-azetidin-1-yl)-1-ethyl-6,8-difluoro-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-(3-amino-3-methyl-1-azetidinyl)-1-ethyl-6,8-difluoro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-(3-amino-3-methylazetidin-1-yl)-1-ethyl-6,8-difluoro-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-(3-amino-3-methyl-azetidin-1-yl)-1-ethyl-6,8-difluoro-4-keto-quinoline-3-carboxylic acid Formula: C16H17F2N3O3 MolecularWeight: 337.321286

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=CC(=C(C(=C21)F)N3CC(C3)(C)N)F)C(=O)O

Isomeric SMILES

CCN1C=C(C(=O)C2=CC(=C(C(=C21)F)N3CC(C3)(C)N)F)C(=O)O

InChI

InChI=1S/C16H17F2N3O3/c1-3-20-5-9(15(23)24)14(22)8-4-10(17)13(11(18)12(8)20)21-6-16(2,19)7-21/h4-5H,3,6-7,19H2,1-2H3,(H,23,24)