1-cyclopropyl-7-(4-ethylpiperazin-4-ium-1-yl)-6-fluoranyl-N-(4-methylphenyl)-4-oxidanylidene-quinoline-3-carboxamide

Systemtic Name: 1-cyclopropyl-7-(4-ethylpiperazin-4-ium-1-yl)-6-fluoranyl-N-(4-methylphenyl)-4-oxidanylidene-quinoline-3-carboxamide Openeye Name: 1-cyclopropyl-7-(4-ethylpiperazin-4-ium-1-yl)-6-fluoro-4-oxo-N-(p-tolyl)quinoline-3-carboxamide CAS Name: 1-cyclopropyl-7-(4-ethyl-1-piperazin-4-iumyl)-6-fluoro-N-(4-methylphenyl)-4-oxo-3-quinolinecarboxamide IUPAC Name: 1-cyclopropyl-7-(4-ethylpiperazin-4-ium-1-yl)-6-fluoro-N-(4-methylphenyl)-4-oxoquinoline-3-carboxamide Traditional Name: 1-cyclopropyl-7-(4-ethylpiperazin-4-ium-1-yl)-6-fluoro-4-keto-N-(p-tolyl)quinoline-3-carboxamide Formula: C26H30FN4O2+ MolecularWeight: 449.540403

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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)NC4=CC=C(C=C4)C)C5CC5)F

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)NC4=CC=C(C=C4)C)C5CC5)F

InChI

InChI=1S/C26H29FN4O2/c1-3-29-10-12-30(13-11-29)24-15-23-20(14-22(24)27)25(32)21(16-31(23)19-8-9-19)26(33)28-18-6-4-17(2)5-7-18/h4-7,14-16,19H,3,8-13H2,1-2H3,(H,28,33)/p+1