1-[1-cyclopropyl-7-(4-ethylpiperazin-4-ium-1-yl)-6-fluoranyl-4-oxidanylidene-quinolin-3-yl]carbonylpiperidine-4-carboxamide

Systemtic Name: 1-[1-cyclopropyl-7-(4-ethylpiperazin-4-ium-1-yl)-6-fluoranyl-4-oxidanylidene-quinolin-3-yl]carbonylpiperidine-4-carboxamide Openeye Name: 1-[1-cyclopropyl-7-(4-ethylpiperazin-4-ium-1-yl)-6-fluoro-4-oxo-quinoline-3-carbonyl]piperidine-4-carboxamide CAS Name: 1-[[1-cyclopropyl-7-(4-ethyl-1-piperazin-4-iumyl)-6-fluoro-4-oxo-3-quinolinyl]-oxomethyl]-4-piperidinecarboxamide IUPAC Name: 1-[1-cyclopropyl-7-(4-ethylpiperazin-4-ium-1-yl)-6-fluoro-4-oxoquinoline-3-carbonyl]piperidine-4-carboxamide Traditional Name: 1-[1-cyclopropyl-7-(4-ethylpiperazin-4-ium-1-yl)-6-fluoro-4-keto-quinoline-3-carbonyl]isonipecotamide Formula: C25H33FN5O3+ MolecularWeight: 470.559623

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)N4CCC(CC4)C(=O)N)C5CC5)F

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)N4CCC(CC4)C(=O)N)C5CC5)F

InChI

InChI=1S/C25H32FN5O3/c1-2-28-9-11-29(12-10-28)22-14-21-18(13-20(22)26)23(32)19(15-31(21)17-3-4-17)25(34)30-7-5-16(6-8-30)24(27)33/h13-17H,2-12H2,1H3,(H2,27,33)/p+1