1-[4-[4-(2-cyclopropylquinolin-4-yl)carbonylpiperazin-1-yl]-3-fluoranyl-phenyl]ethanone

Systemtic Name: 1-[4-[4-(2-cyclopropylquinolin-4-yl)carbonylpiperazin-1-yl]-3-fluoranyl-phenyl]ethanone Openeye Name: 1-[4-[4-(2-cyclopropylquinoline-4-carbonyl)piperazin-1-yl]-3-fluoro-phenyl]ethanone CAS Name: 1-[4-[4-[(2-cyclopropyl-4-quinolinyl)-oxomethyl]-1-piperazinyl]-3-fluorophenyl]ethanone IUPAC Name: 1-[4-[4-(2-cyclopropylquinoline-4-carbonyl)piperazin-1-yl]-3-fluorophenyl]ethanone Traditional Name: 1-[4-[4-(2-cyclopropylquinoline-4-carbonyl)piperazino]-3-fluoro-phenyl]ethanone Formula: C25H24FN3O2 MolecularWeight: 417.475363

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)N2CCN(CC2)C(=O)C3=CC(=NC4=CC=CC=C43)C5CC5)F

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)N2CCN(CC2)C(=O)C3=CC(=NC4=CC=CC=C43)C5CC5)F

InChI

InChI=1S/C25H24FN3O2/c1-16(30)18-8-9-24(21(26)14-18)28-10-12-29(13-11-28)25(31)20-15-23(17-6-7-17)27-22-5-3-2-4-19(20)22/h2-5,8-9,14-15,17H,6-7,10-13H2,1H3