ethyl 6-fluoranyl-1-(2-fluoranyl-4-nitro-phenyl)-7-(4-methylpiperazin-1-yl)-4-oxidanylidene-quinoline-3-carboxylate

Systemtic Name: ethyl 6-fluoranyl-1-(2-fluoranyl-4-nitro-phenyl)-7-(4-methylpiperazin-1-yl)-4-oxidanylidene-quinoline-3-carboxylate Openeye Name: ethyl 6-fluoro-1-(2-fluoro-4-nitro-phenyl)-7-(4-methylpiperazin-1-yl)-4-oxo-quinoline-3-carboxylate CAS Name: 6-fluoro-1-(2-fluoro-4-nitrophenyl)-7-(4-methyl-1-piperazinyl)-4-oxo-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 6-fluoro-1-(2-fluoro-4-nitrophenyl)-7-(4-methylpiperazin-1-yl)-4-oxoquinoline-3-carboxylate Traditional Name: 6-fluoro-1-(2-fluoro-4-nitro-phenyl)-4-keto-7-(4-methylpiperazino)quinoline-3-carboxylic acid ethyl ester Formula: C23H22F2N4O5 MolecularWeight: 472.441386

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN(C2=CC(=C(C=C2C1=O)F)N3CCN(CC3)C)C4=C(C=C(C=C4)[N+](=O)[O-])F

Isomeric SMILES

CCOC(=O)C1=CN(C2=CC(=C(C=C2C1=O)F)N3CCN(CC3)C)C4=C(C=C(C=C4)[N+](=O)[O-])F

InChI

InChI=1S/C23H22F2N4O5/c1-3-34-23(31)16-13-28(19-5-4-14(29(32)33)10-17(19)24)20-12-21(18(25)11-15(20)22(16)30)27-8-6-26(2)7-9-27/h4-5,10-13H,3,6-9H2,1-2H3