ethyl 1-(4-fluorophenyl)-7-(4-methylpiperazin-1-yl)-6-nitro-4-oxidanylidene-quinoline-3-carboxylate

Systemtic Name: ethyl 1-(4-fluorophenyl)-7-(4-methylpiperazin-1-yl)-6-nitro-4-oxidanylidene-quinoline-3-carboxylate Openeye Name: ethyl 1-(4-fluorophenyl)-7-(4-methylpiperazin-1-yl)-6-nitro-4-oxo-quinoline-3-carboxylate CAS Name: 1-(4-fluorophenyl)-7-(4-methyl-1-piperazinyl)-6-nitro-4-oxo-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(4-fluorophenyl)-7-(4-methylpiperazin-1-yl)-6-nitro-4-oxoquinoline-3-carboxylate Traditional Name: 1-(4-fluorophenyl)-4-keto-7-(4-methylpiperazino)-6-nitro-quinoline-3-carboxylic acid ethyl ester Formula: C23H23FN4O5 MolecularWeight: 454.450923

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H23FN4O5/c1-3-33-23(30)18-14-27(16-6-4-15(24)5-7-16)19-13-20(26-10-8-25(2)9-11-26)21(28(31)32)12-17(19)22(18)29/h4-7,12-14H,3,8-11H2,1-2H3