1-[4-[4-(5-bromanyl-2-morpholin-4-yl-phenyl)carbonylpiperazin-1-yl]-3-fluoranyl-phenyl]ethanone

Systemtic Name: 1-[4-[4-(5-bromanyl-2-morpholin-4-yl-phenyl)carbonylpiperazin-1-yl]-3-fluoranyl-phenyl]ethanone Openeye Name: 1-[4-[4-(5-bromo-2-morpholino-benzoyl)piperazin-1-yl]-3-fluoro-phenyl]ethanone CAS Name: 1-[4-[4-[[5-bromo-2-(4-morpholinyl)phenyl]-oxomethyl]-1-piperazinyl]-3-fluorophenyl]ethanone IUPAC Name: 1-[4-[4-(5-bromo-2-morpholin-4-ylbenzoyl)piperazin-1-yl]-3-fluorophenyl]ethanone Traditional Name: 1-[4-[4-(5-bromo-2-morpholino-benzoyl)piperazino]-3-fluoro-phenyl]ethanone Formula: C23H25BrFN3O3 MolecularWeight: 490.365303

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)N2CCN(CC2)C(=O)C3=C(C=CC(=C3)Br)N4CCOCC4)F

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)N2CCN(CC2)C(=O)C3=C(C=CC(=C3)Br)N4CCOCC4)F

InChI

InChI=1S/C23H25BrFN3O3/c1-16(29)17-2-4-22(20(25)14-17)26-6-8-28(9-7-26)23(30)19-15-18(24)3-5-21(19)27-10-12-31-13-11-27/h2-5,14-15H,6-13H2,1H3