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

Systemtic Name: 5-azanyl-7-(4-azanyl-3-ethyl-3,5-dimethyl-piperidin-1-yl)-1-cyclopropyl-6-fluoranyl-8-methoxy-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 5-amino-7-(4-amino-3-ethyl-3,5-dimethyl-1-piperidyl)-1-cyclopropyl-6-fluoro-8-methoxy-4-oxo-quinoline-3-carboxylic acid CAS Name: 5-amino-7-(4-amino-3-ethyl-3,5-dimethyl-1-piperidinyl)-1-cyclopropyl-6-fluoro-8-methoxy-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 5-amino-7-(4-amino-3-ethyl-3,5-dimethylpiperidin-1-yl)-1-cyclopropyl-6-fluoro-8-methoxy-4-oxoquinoline-3-carboxylic acid Traditional Name: 5-amino-7-(4-amino-3-ethyl-3,5-dimethyl-piperidino)-1-cyclopropyl-6-fluoro-4-keto-8-methoxy-quinoline-3-carboxylic acid Formula: C23H31FN4O4 MolecularWeight: 446.515043

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1(CN(CC(C1N)C)C2=C(C3=C(C(=C2F)N)C(=O)C(=CN3C4CC4)C(=O)O)OC)C

Isomeric SMILES

CCC1(CN(CC(C1N)C)C2=C(C3=C(C(=C2F)N)C(=O)C(=CN3C4CC4)C(=O)O)OC)C

InChI

InChI=1S/C23H31FN4O4/c1-5-23(3)10-27(8-11(2)21(23)26)18-15(24)16(25)14-17(20(18)32-4)28(12-6-7-12)9-13(19(14)29)22(30)31/h9,11-12,21H,5-8,10,25-26H2,1-4H3,(H,30,31)