1-(5-azanyl-4-fluoranyl-2-methyl-phenyl)-7-(3,3-dimethylazetidin-1-yl)-6-fluoranyl-5,8-dimethyl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 1-(5-azanyl-4-fluoranyl-2-methyl-phenyl)-7-(3,3-dimethylazetidin-1-yl)-6-fluoranyl-5,8-dimethyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-(5-amino-4-fluoro-2-methyl-phenyl)-7-(3,3-dimethylazetidin-1-yl)-6-fluoro-5,8-dimethyl-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-(5-amino-4-fluoro-2-methylphenyl)-7-(3,3-dimethyl-1-azetidinyl)-6-fluoro-5,8-dimethyl-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-(5-amino-4-fluoro-2-methylphenyl)-7-(3,3-dimethylazetidin-1-yl)-6-fluoro-5,8-dimethyl-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-(5-amino-4-fluoro-2-methyl-phenyl)-7-(3,3-dimethylazetidin-1-yl)-6-fluoro-4-keto-5,8-dimethyl-quinoline-3-carboxylic acid Formula: C24H25F2N3O3 MolecularWeight: 441.470406

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1N2C=C(C(=O)C3=C(C(=C(C(=C32)C)N4CC(C4)(C)C)F)C)C(=O)O)N)F

Isomeric SMILES

CC1=CC(=C(C=C1N2C=C(C(=O)C3=C(C(=C(C(=C32)C)N4CC(C4)(C)C)F)C)C(=O)O)N)F

InChI

InChI=1S/C24H25F2N3O3/c1-11-6-15(25)16(27)7-17(11)29-8-14(23(31)32)22(30)18-12(2)19(26)21(13(3)20(18)29)28-9-24(4,5)10-28/h6-8H,9-10,27H2,1-5H3,(H,31,32)