5-azanyl-7-(4-azanyl-3-ethyl-3-methyl-piperidin-1-yl)-1-cyclopropyl-6-fluoranyl-8-methoxy-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 5-azanyl-7-(4-azanyl-3-ethyl-3-methyl-piperidin-1-yl)-1-cyclopropyl-6-fluoranyl-8-methoxy-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 5-amino-7-(4-amino-3-ethyl-3-methyl-1-piperidyl)-1-cyclopropyl-6-fluoro-8-methoxy-4-oxo-quinoline-3-carboxylic acid CAS Name: 5-amino-7-(4-amino-3-ethyl-3-methyl-1-piperidinyl)-1-cyclopropyl-6-fluoro-8-methoxy-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 5-amino-7-(4-amino-3-ethyl-3-methylpiperidin-1-yl)-1-cyclopropyl-6-fluoro-8-methoxy-4-oxoquinoline-3-carboxylic acid Traditional Name: 5-amino-7-(4-amino-3-ethyl-3-methyl-piperidino)-1-cyclopropyl-6-fluoro-4-keto-8-methoxy-quinoline-3-carboxylic acid Formula: C22H29FN4O4 MolecularWeight: 432.488463

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(CN(CCC1N)C2=C(C3=C(C(=C2F)N)C(=O)C(=CN3C4CC4)C(=O)O)OC)C

Isomeric SMILES

CCC1(CN(CCC1N)C2=C(C3=C(C(=C2F)N)C(=O)C(=CN3C4CC4)C(=O)O)OC)C

InChI

InChI=1S/C22H29FN4O4/c1-4-22(2)10-26(8-7-13(22)24)18-15(23)16(25)14-17(20(18)31-3)27(11-5-6-11)9-12(19(14)28)21(29)30/h9,11,13H,4-8,10,24-25H2,1-3H3,(H,29,30)