ethyl 5-azanyl-1-cyclopropyl-8-fluoranyl-7-(4-methylpiperazin-1-yl)-6-nitro-4-oxidanylidene-quinoline-3-carboxylate

Systemtic Name: ethyl 5-azanyl-1-cyclopropyl-8-fluoranyl-7-(4-methylpiperazin-1-yl)-6-nitro-4-oxidanylidene-quinoline-3-carboxylate Openeye Name: ethyl 5-amino-1-cyclopropyl-8-fluoro-7-(4-methylpiperazin-1-yl)-6-nitro-4-oxo-quinoline-3-carboxylate CAS Name: 5-amino-1-cyclopropyl-8-fluoro-7-(4-methyl-1-piperazinyl)-6-nitro-4-oxo-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-1-cyclopropyl-8-fluoro-7-(4-methylpiperazin-1-yl)-6-nitro-4-oxoquinoline-3-carboxylate Traditional Name: 5-amino-1-cyclopropyl-8-fluoro-4-keto-7-(4-methylpiperazino)-6-nitro-quinoline-3-carboxylic acid ethyl ester Formula: C20H24FN5O5 MolecularWeight: 433.433463

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN(C2=C(C1=O)C(=C(C(=C2F)N3CCN(CC3)C)[N+](=O)[O-])N)C4CC4

Isomeric SMILES

CCOC(=O)C1=CN(C2=C(C1=O)C(=C(C(=C2F)N3CCN(CC3)C)[N+](=O)[O-])N)C4CC4

InChI

InChI=1S/C20H24FN5O5/c1-3-31-20(28)12-10-25(11-4-5-11)16-13(19(12)27)15(22)18(26(29)30)17(14(16)21)24-8-6-23(2)7-9-24/h10-11H,3-9,22H2,1-2H3