5-azanyl-1-cyclopropyl-7-(4-ethyl-5-oxidanylidene-1,4-diazepan-1-yl)-6,8-bis(fluoranyl)-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 5-azanyl-1-cyclopropyl-7-(4-ethyl-5-oxidanylidene-1,4-diazepan-1-yl)-6,8-bis(fluoranyl)-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 5-amino-1-cyclopropyl-7-(4-ethyl-5-oxo-1,4-diazepan-1-yl)-6,8-difluoro-4-oxo-quinoline-3-carboxylic acid CAS Name: 5-amino-1-cyclopropyl-7-(4-ethyl-5-oxo-1,4-diazepan-1-yl)-6,8-difluoro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 5-amino-1-cyclopropyl-7-(4-ethyl-5-oxo-1,4-diazepan-1-yl)-6,8-difluoro-4-oxoquinoline-3-carboxylic acid Traditional Name: 5-amino-1-cyclopropyl-7-(4-ethyl-5-keto-1,4-diazepan-1-yl)-6,8-difluoro-4-keto-quinoline-3-carboxylic acid Formula: C20H22F2N4O4 MolecularWeight: 420.409886

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CCC1=O)C2=C(C3=C(C(=C2F)N)C(=O)C(=CN3C4CC4)C(=O)O)F

Isomeric SMILES

CCN1CCN(CCC1=O)C2=C(C3=C(C(=C2F)N)C(=O)C(=CN3C4CC4)C(=O)O)F

InChI

InChI=1S/C20H22F2N4O4/c1-2-24-7-8-25(6-5-12(24)27)18-14(21)16(23)13-17(15(18)22)26(10-3-4-10)9-11(19(13)28)20(29)30/h9-10H,2-8,23H2,1H3,(H,29,30)