1-[4-[4-[4,5-bis(fluoranyl)-2-methyl-phenyl]carbonylpiperazin-1-yl]-3-fluoranyl-phenyl]propan-1-one

Systemtic Name: 1-[4-[4-[4,5-bis(fluoranyl)-2-methyl-phenyl]carbonylpiperazin-1-yl]-3-fluoranyl-phenyl]propan-1-one Openeye Name: 1-[4-[4-(4,5-difluoro-2-methyl-benzoyl)piperazin-1-yl]-3-fluoro-phenyl]propan-1-one CAS Name: 1-[4-[4-[(4,5-difluoro-2-methylphenyl)-oxomethyl]-1-piperazinyl]-3-fluorophenyl]-1-propanone IUPAC Name: 1-[4-[4-(4,5-difluoro-2-methylbenzoyl)piperazin-1-yl]-3-fluorophenyl]propan-1-one Traditional Name: 1-[4-[4-(4,5-difluoro-2-methyl-benzoyl)piperazino]-3-fluoro-phenyl]propan-1-one Formula: C21H21F3N2O2 MolecularWeight: 390.39885

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=CC(=C(C=C1)N2CCN(CC2)C(=O)C3=CC(=C(C=C3C)F)F)F

Isomeric SMILES

CCC(=O)C1=CC(=C(C=C1)N2CCN(CC2)C(=O)C3=CC(=C(C=C3C)F)F)F

InChI

InChI=1S/C21H21F3N2O2/c1-3-20(27)14-4-5-19(18(24)11-14)25-6-8-26(9-7-25)21(28)15-12-17(23)16(22)10-13(15)2/h4-5,10-12H,3,6-9H2,1-2H3