ethyl 4-[1-ethyl-6-fluoranyl-7-(4-methylpiperazin-4-ium-1-yl)-4-oxidanylidene-quinolin-3-yl]carbonylpiperazine-1-carboxylate

Systemtic Name: ethyl 4-[1-ethyl-6-fluoranyl-7-(4-methylpiperazin-4-ium-1-yl)-4-oxidanylidene-quinolin-3-yl]carbonylpiperazine-1-carboxylate Openeye Name: ethyl 4-[1-ethyl-6-fluoro-7-(4-methylpiperazin-4-ium-1-yl)-4-oxo-quinoline-3-carbonyl]piperazine-1-carboxylate CAS Name: 4-[[1-ethyl-6-fluoro-7-(4-methyl-1-piperazin-4-iumyl)-4-oxo-3-quinolinyl]-oxomethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[1-ethyl-6-fluoro-7-(4-methylpiperazin-4-ium-1-yl)-4-oxoquinoline-3-carbonyl]piperazine-1-carboxylate Traditional Name: 4-[1-ethyl-6-fluoro-4-keto-7-(4-methylpiperazin-4-ium-1-yl)quinoline-3-carbonyl]piperazine-1-carboxylic acid ethyl ester Formula: C24H33FN5O4+ MolecularWeight: 474.548323

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CC[NH+](CC3)C)F)C(=O)N4CCN(CC4)C(=O)OCC

Isomeric SMILES

CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CC[NH+](CC3)C)F)C(=O)N4CCN(CC4)C(=O)OCC

InChI

InChI=1S/C24H32FN5O4/c1-4-27-16-18(23(32)29-10-12-30(13-11-29)24(33)34-5-2)22(31)17-14-19(25)21(15-20(17)27)28-8-6-26(3)7-9-28/h14-16H,4-13H2,1-3H3/p+1