methyl 1-ethyl-6-fluoranyl-7-(1-methylpiperazin-1-ium-1-yl)-4-oxidanylidene-quinoline-3-carboxylate

Systemtic Name: methyl 1-ethyl-6-fluoranyl-7-(1-methylpiperazin-1-ium-1-yl)-4-oxidanylidene-quinoline-3-carboxylate Openeye Name: methyl 1-ethyl-6-fluoro-7-(1-methylpiperazin-1-ium-1-yl)-4-oxo-quinoline-3-carboxylate CAS Name: 1-ethyl-6-fluoro-7-(1-methyl-1-piperazin-1-iumyl)-4-oxo-3-quinolinecarboxylic acid methyl ester IUPAC Name: methyl 1-ethyl-6-fluoro-7-(1-methylpiperazin-1-ium-1-yl)-4-oxoquinoline-3-carboxylate Traditional Name: 1-ethyl-6-fluoro-4-keto-7-(1-methylpiperazin-1-ium-1-yl)quinoline-3-carboxylic acid methyl ester Formula: C18H23FN3O3+ MolecularWeight: 348.391923

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=CC(=C(C=C21)[N+]3(CCNCC3)C)F)C(=O)OC

Isomeric SMILES

CCN1C=C(C(=O)C2=CC(=C(C=C21)[N+]3(CCNCC3)C)F)C(=O)OC

InChI

InChI=1S/C18H23FN3O3/c1-4-21-11-13(18(24)25-3)17(23)12-9-14(19)16(10-15(12)21)22(2)7-5-20-6-8-22/h9-11,20H,4-8H2,1-3H3/q+1