ethyl 1-cyclopropyl-7-(4-methylpiperazin-1-yl)-6-nitro-4-oxidanylidene-quinoline-2-carboxylate

Systemtic Name: ethyl 1-cyclopropyl-7-(4-methylpiperazin-1-yl)-6-nitro-4-oxidanylidene-quinoline-2-carboxylate Openeye Name: ethyl 1-cyclopropyl-7-(4-methylpiperazin-1-yl)-6-nitro-4-oxo-quinoline-2-carboxylate CAS Name: 1-cyclopropyl-7-(4-methyl-1-piperazinyl)-6-nitro-4-oxo-2-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-cyclopropyl-7-(4-methylpiperazin-1-yl)-6-nitro-4-oxoquinoline-2-carboxylate Traditional Name: 1-cyclopropyl-4-keto-7-(4-methylpiperazino)-6-nitro-quinaldic acid ethyl ester Formula: C20H24N4O5 MolecularWeight: 400.42836

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=O)C2=CC(=C(C=C2N1C3CC3)N4CCN(CC4)C)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC(=O)C2=CC(=C(C=C2N1C3CC3)N4CCN(CC4)C)[N+](=O)[O-]

InChI

InChI=1S/C20H24N4O5/c1-3-29-20(26)18-12-19(25)14-10-17(24(27)28)16(22-8-6-21(2)7-9-22)11-15(14)23(18)13-4-5-13/h10-13H,3-9H2,1-2H3