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

Systemtic Name: 7-(3-azanyl-3-methyl-azetidin-1-yl)-1-tert-butyl-6,8-bis(fluoranyl)-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-(3-amino-3-methyl-azetidin-1-yl)-1-tert-butyl-6,8-difluoro-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-(3-amino-3-methyl-1-azetidinyl)-1-tert-butyl-6,8-difluoro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-(3-amino-3-methylazetidin-1-yl)-1-tert-butyl-6,8-difluoro-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-(3-amino-3-methyl-azetidin-1-yl)-1-tert-butyl-6,8-difluoro-4-keto-quinoline-3-carboxylic acid Formula: C18H21F2N3O3 MolecularWeight: 365.374446

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CN(C1)C2=C(C=C3C(=C2F)N(C=C(C3=O)C(=O)O)C(C)(C)C)F)N

Isomeric SMILES

CC1(CN(C1)C2=C(C=C3C(=C2F)N(C=C(C3=O)C(=O)O)C(C)(C)C)F)N

InChI

InChI=1S/C18H21F2N3O3/c1-17(2,3)23-6-10(16(25)26)15(24)9-5-11(19)14(12(20)13(9)23)22-7-18(4,21)8-22/h5-6H,7-8,21H2,1-4H3,(H,25,26)