ethyl 1-cyclopropyl-5,8-bis(fluoranyl)-7-(4-methylpiperazin-1-yl)-6-nitro-4-oxidanylidene-quinoline-2-carboxylate

Systemtic Name: ethyl 1-cyclopropyl-5,8-bis(fluoranyl)-7-(4-methylpiperazin-1-yl)-6-nitro-4-oxidanylidene-quinoline-2-carboxylate Openeye Name: ethyl 1-cyclopropyl-5,8-difluoro-7-(4-methylpiperazin-1-yl)-6-nitro-4-oxo-quinoline-2-carboxylate CAS Name: 1-cyclopropyl-5,8-difluoro-7-(4-methyl-1-piperazinyl)-6-nitro-4-oxo-2-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-cyclopropyl-5,8-difluoro-7-(4-methylpiperazin-1-yl)-6-nitro-4-oxoquinoline-2-carboxylate Traditional Name: 1-cyclopropyl-5,8-difluoro-4-keto-7-(4-methylpiperazino)-6-nitro-quinaldic acid ethyl ester Formula: C20H22F2N4O5 MolecularWeight: 436.409286

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=O)C2=C(N1C3CC3)C(=C(C(=C2F)[N+](=O)[O-])N4CCN(CC4)C)F

Isomeric SMILES

CCOC(=O)C1=CC(=O)C2=C(N1C3CC3)C(=C(C(=C2F)[N+](=O)[O-])N4CCN(CC4)C)F

InChI

InChI=1S/C20H22F2N4O5/c1-3-31-20(28)12-10-13(27)14-15(21)19(26(29)30)18(24-8-6-23(2)7-9-24)16(22)17(14)25(12)11-4-5-11/h10-11H,3-9H2,1-2H3