2-(3-azanylazetidin-1-yl)-1-cyclopropyl-6-fluoranyl-4-oxidanylidene-7-propan-2-yl-quinoline-3-carboxylic acid

Systemtic Name: 2-(3-azanylazetidin-1-yl)-1-cyclopropyl-6-fluoranyl-4-oxidanylidene-7-propan-2-yl-quinoline-3-carboxylic acid Openeye Name: 2-(3-aminoazetidin-1-yl)-1-cyclopropyl-6-fluoro-7-isopropyl-4-oxo-quinoline-3-carboxylic acid CAS Name: 2-(3-amino-1-azetidinyl)-1-cyclopropyl-6-fluoro-4-oxo-7-propan-2-yl-3-quinolinecarboxylic acid IUPAC Name: 2-(3-aminoazetidin-1-yl)-1-cyclopropyl-6-fluoro-4-oxo-7-propan-2-ylquinoline-3-carboxylic acid Traditional Name: 2-(3-aminoazetidin-1-yl)-1-cyclopropyl-6-fluoro-7-isopropyl-4-keto-quinoline-3-carboxylic acid Formula: C19H22FN3O3 MolecularWeight: 359.394683

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C=C2C(=C1)N(C(=C(C2=O)C(=O)O)N3CC(C3)N)C4CC4)F

Isomeric SMILES

CC(C)C1=C(C=C2C(=C1)N(C(=C(C2=O)C(=O)O)N3CC(C3)N)C4CC4)F

InChI

InChI=1S/C19H22FN3O3/c1-9(2)12-6-15-13(5-14(12)20)17(24)16(19(25)26)18(22-7-10(21)8-22)23(15)11-3-4-11/h5-6,9-11H,3-4,7-8,21H2,1-2H3,(H,25,26)