5-azanyl-1-cyclopropyl-7-(7,9-diazabicyclo[3.2.2]nonan-7-yl)-6,8-bis(fluoranyl)-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 5-azanyl-1-cyclopropyl-7-(7,9-diazabicyclo[3.2.2]nonan-7-yl)-6,8-bis(fluoranyl)-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 5-amino-1-cyclopropyl-7-(7,9-diazabicyclo[3.2.2]nonan-7-yl)-6,8-difluoro-4-oxo-quinoline-3-carboxylic acid CAS Name: 5-amino-1-cyclopropyl-7-(7,9-diazabicyclo[3.2.2]nonan-7-yl)-6,8-difluoro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 5-amino-1-cyclopropyl-7-(7,9-diazabicyclo[3.2.2]nonan-7-yl)-6,8-difluoro-4-oxoquinoline-3-carboxylic acid Traditional Name: 5-amino-1-cyclopropyl-7-(7,9-diazabicyclo[3.2.2]nonan-7-yl)-6,8-difluoro-4-keto-quinoline-3-carboxylic acid Formula: C20H22F2N4O3 MolecularWeight: 404.410486

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2CNC(C1)CN2C3=C(C4=C(C(=C3F)N)C(=O)C(=CN4C5CC5)C(=O)O)F

Isomeric SMILES

C1CC2CNC(C1)CN2C3=C(C4=C(C(=C3F)N)C(=O)C(=CN4C5CC5)C(=O)O)F

InChI

InChI=1S/C20H22F2N4O3/c21-14-16(23)13-17(26(10-4-5-10)8-12(19(13)27)20(28)29)15(22)18(14)25-7-9-2-1-3-11(25)6-24-9/h8-11,24H,1-7,23H2,(H,28,29)