7-(3-azanyl-2-methyl-azetidin-1-yl)-1-tert-butyl-8-chloranyl-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 7-(3-azanyl-2-methyl-azetidin-1-yl)-1-tert-butyl-8-chloranyl-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-(3-amino-2-methyl-azetidin-1-yl)-1-tert-butyl-8-chloro-6-fluoro-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-(3-amino-2-methyl-1-azetidinyl)-1-tert-butyl-8-chloro-6-fluoro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-(3-amino-2-methylazetidin-1-yl)-1-tert-butyl-8-chloro-6-fluoro-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-(3-amino-2-methyl-azetidin-1-yl)-1-tert-butyl-8-chloro-6-fluoro-4-keto-quinoline-3-carboxylic acid Formula: C18H21ClFN3O3 MolecularWeight: 381.829043

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(CN1C2=C(C=C3C(=C2Cl)N(C=C(C3=O)C(=O)O)C(C)(C)C)F)N

Isomeric SMILES

CC1C(CN1C2=C(C=C3C(=C2Cl)N(C=C(C3=O)C(=O)O)C(C)(C)C)F)N

InChI

InChI=1S/C18H21ClFN3O3/c1-8-12(21)7-22(8)15-11(20)5-9-14(13(15)19)23(18(2,3)4)6-10(16(9)24)17(25)26/h5-6,8,12H,7,21H2,1-4H3,(H,25,26)