7-[2-(2-cyanoethylamino)-6-azaspiro[2.4]heptan-6-yl]-1-cyclopropyl-6-fluoranyl-8-methyl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 7-[2-(2-cyanoethylamino)-6-azaspiro[2.4]heptan-6-yl]-1-cyclopropyl-6-fluoranyl-8-methyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-[2-(2-cyanoethylamino)-6-azaspiro[2.4]heptan-6-yl]-1-cyclopropyl-6-fluoro-8-methyl-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-[2-(2-cyanoethylamino)-6-azaspiro[2.4]heptan-6-yl]-1-cyclopropyl-6-fluoro-8-methyl-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-[2-(2-cyanoethylamino)-6-azaspiro[2.4]heptan-6-yl]-1-cyclopropyl-6-fluoro-8-methyl-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-[2-(2-cyanoethylamino)-6-azaspiro[2.4]heptan-6-yl]-1-cyclopropyl-6-fluoro-4-keto-8-methyl-quinoline-3-carboxylic acid Formula: C23H25FN4O3 MolecularWeight: 424.468003

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1N3CCC4(C3)CC4NCCC#N)F)C(=O)C(=CN2C5CC5)C(=O)O

Isomeric SMILES

CC1=C2C(=CC(=C1N3CCC4(C3)CC4NCCC#N)F)C(=O)C(=CN2C5CC5)C(=O)O

InChI

InChI=1S/C23H25FN4O3/c1-13-19-15(21(29)16(22(30)31)11-28(19)14-3-4-14)9-17(24)20(13)27-8-5-23(12-27)10-18(23)26-7-2-6-25/h9,11,14,18,26H,2-5,7-8,10,12H2,1H3,(H,30,31)