7-(3-azanyl-3-methyl-azetidin-1-yl)-1-tert-butyl-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 7-(3-azanyl-3-methyl-azetidin-1-yl)-1-tert-butyl-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-(3-amino-3-methyl-azetidin-1-yl)-1-tert-butyl-6-fluoro-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-(3-amino-3-methyl-1-azetidinyl)-1-tert-butyl-6-fluoro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-(3-amino-3-methylazetidin-1-yl)-1-tert-butyl-6-fluoro-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-(3-amino-3-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:

CC1(CN(C1)C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)C(C)(C)C)F)N

Isomeric SMILES

CC1(CN(C1)C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)C(C)(C)C)F)N

InChI

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