1-cyclopropyl-7-(4-ethanoylpiperazin-1-yl)-6-fluoranyl-4-oxidanylidene-N-phenyl-quinoline-3-carboxamide

Systemtic Name: 1-cyclopropyl-7-(4-ethanoylpiperazin-1-yl)-6-fluoranyl-4-oxidanylidene-N-phenyl-quinoline-3-carboxamide Openeye Name: 7-(4-acetylpiperazin-1-yl)-1-cyclopropyl-6-fluoro-4-oxo-N-phenyl-quinoline-3-carboxamide CAS Name: 7-(4-acetyl-1-piperazinyl)-1-cyclopropyl-6-fluoro-4-oxo-N-phenyl-3-quinolinecarboxamide IUPAC Name: 7-(4-acetylpiperazin-1-yl)-1-cyclopropyl-6-fluoro-4-oxo-N-phenylquinoline-3-carboxamide Traditional Name: 7-(4-acetylpiperazino)-1-cyclopropyl-6-fluoro-4-keto-N-phenyl-quinoline-3-carboxamide Formula: C25H25FN4O3 MolecularWeight: 448.489403

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)NC4=CC=CC=C4)C5CC5)F

Isomeric SMILES

CC(=O)N1CCN(CC1)C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)NC4=CC=CC=C4)C5CC5)F

InChI

InChI=1S/C25H25FN4O3/c1-16(31)28-9-11-29(12-10-28)23-14-22-19(13-21(23)26)24(32)20(15-30(22)18-7-8-18)25(33)27-17-5-3-2-4-6-17/h2-6,13-15,18H,7-12H2,1H3,(H,27,33)