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

Systemtic Name: 1-ethyl-6,8-bis(fluoranyl)-7-(9-methyl-7,9-diazabicyclo[3.2.2]nonan-7-yl)-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-ethyl-6,8-difluoro-7-(9-methyl-7,9-diazabicyclo[3.2.2]nonan-7-yl)-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-ethyl-6,8-difluoro-7-(9-methyl-7,9-diazabicyclo[3.2.2]nonan-7-yl)-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-ethyl-6,8-difluoro-7-(9-methyl-7,9-diazabicyclo[3.2.2]nonan-7-yl)-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-ethyl-6,8-difluoro-4-keto-7-(9-methyl-7,9-diazabicyclo[3.2.2]nonan-7-yl)quinoline-3-carboxylic acid Formula: C20H23F2N3O3 MolecularWeight: 391.411726

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=CC(=C(C(=C21)F)N3CC4CCCC3CN4C)F)C(=O)O

Isomeric SMILES

CCN1C=C(C(=O)C2=CC(=C(C(=C21)F)N3CC4CCCC3CN4C)F)C(=O)O

InChI

InChI=1S/C20H23F2N3O3/c1-3-24-10-14(20(27)28)19(26)13-7-15(21)18(16(22)17(13)24)25-9-11-5-4-6-12(25)8-23(11)2/h7,10-12H,3-6,8-9H2,1-2H3,(H,27,28)