7-(5-azanyl-7-azaspiro[2.5]octan-2-yl)-1-cyclopropyl-6-fluoranyl-8-methoxy-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 7-(5-azanyl-7-azaspiro[2.5]octan-2-yl)-1-cyclopropyl-6-fluoranyl-8-methoxy-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-(5-amino-7-azaspiro[2.5]octan-2-yl)-1-cyclopropyl-6-fluoro-8-methoxy-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-(5-amino-7-azaspiro[2.5]octan-2-yl)-1-cyclopropyl-6-fluoro-8-methoxy-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-(5-amino-7-azaspiro[2.5]octan-2-yl)-1-cyclopropyl-6-fluoro-8-methoxy-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-(5-amino-7-azaspiro[2.5]octan-2-yl)-1-cyclopropyl-6-fluoro-4-keto-8-methoxy-quinoline-3-carboxylic acid Formula: C21H24FN3O4 MolecularWeight: 401.431363

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=CC(=C1C3CC34CC(CNC4)N)F)C(=O)C(=CN2C5CC5)C(=O)O

Isomeric SMILES

COC1=C2C(=CC(=C1C3CC34CC(CNC4)N)F)C(=O)C(=CN2C5CC5)C(=O)O

InChI

InChI=1S/C21H24FN3O4/c1-29-19-16(14-6-21(14)5-10(23)7-24-9-21)15(22)4-12-17(19)25(11-2-3-11)8-13(18(12)26)20(27)28/h4,8,10-11,14,24H,2-3,5-7,9,23H2,1H3,(H,27,28)