7-[(2S,3R)-3-azanyl-2-methyl-azetidin-1-yl]-1-tert-butyl-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 7-[(2S,3R)-3-azanyl-2-methyl-azetidin-1-yl]-1-tert-butyl-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-[(2S,3R)-3-amino-2-methyl-azetidin-1-yl]-1-tert-butyl-6-fluoro-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-[(2S,3R)-3-amino-2-methyl-1-azetidinyl]-1-tert-butyl-6-fluoro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-[(2S,3R)-3-amino-2-methylazetidin-1-yl]-1-tert-butyl-6-fluoro-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-[(2S,3R)-3-amino-2-methyl-azetidin-1-yl]-1-tert-butyl-6-fluoro-4-keto-quinoline-3-carboxylic acid Formula: C18H22FN3O3 MolecularWeight: 347.383983

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(CN1C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)C(C)(C)C)F)N

Isomeric SMILES

C[C@H]1[C@@H](CN1C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)C(C)(C)C)F)N

InChI

InChI=1S/C18H22FN3O3/c1-9-13(20)8-21(9)15-6-14-10(5-12(15)19)16(23)11(17(24)25)7-22(14)18(2,3)4/h5-7,9,13H,8,20H2,1-4H3,(H,24,25)/t9-,13+/m0/s1