5-fluoranyl-3-[[4-(4-methylpiperazin-1-yl)-8-nitro-quinolin-3-yl]carbonylamino]-4-oxidanylidene-pentanoic acid

Systemtic Name: 5-fluoranyl-3-[[4-(4-methylpiperazin-1-yl)-8-nitro-quinolin-3-yl]carbonylamino]-4-oxidanylidene-pentanoic acid Openeye Name: 5-fluoro-3-[[4-(4-methylpiperazin-1-yl)-8-nitro-quinoline-3-carbonyl]amino]-4-oxo-pentanoic acid CAS Name: 5-fluoro-3-[[[4-(4-methyl-1-piperazinyl)-8-nitro-3-quinolinyl]-oxomethyl]amino]-4-oxopentanoic acid IUPAC Name: 5-fluoro-3-[[4-(4-methylpiperazin-1-yl)-8-nitroquinoline-3-carbonyl]amino]-4-oxopentanoic acid Traditional Name: 5-fluoro-4-keto-3-[[4-(4-methylpiperazino)-8-nitro-quinoline-3-carbonyl]amino]valeric acid Formula: C20H22FN5O6 MolecularWeight: 447.416983

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=C3C=CC=C(C3=NC=C2C(=O)NC(CC(=O)O)C(=O)CF)[N+](=O)[O-]

Isomeric SMILES

CN1CCN(CC1)C2=C3C=CC=C(C3=NC=C2C(=O)NC(CC(=O)O)C(=O)CF)[N+](=O)[O-]

InChI

InChI=1S/C20H22FN5O6/c1-24-5-7-25(8-6-24)19-12-3-2-4-15(26(31)32)18(12)22-11-13(19)20(30)23-14(9-17(28)29)16(27)10-21/h2-4,11,14H,5-10H2,1H3,(H,23,30)(H,28,29)