1-[4-[4-(4-bromophenyl)carbonylpiperazin-1-yl]-3-fluoranyl-phenyl]propan-1-one

Systemtic Name: 1-[4-[4-(4-bromophenyl)carbonylpiperazin-1-yl]-3-fluoranyl-phenyl]propan-1-one Openeye Name: 1-[4-[4-(4-bromobenzoyl)piperazin-1-yl]-3-fluoro-phenyl]propan-1-one CAS Name: 1-[4-[4-[(4-bromophenyl)-oxomethyl]-1-piperazinyl]-3-fluorophenyl]-1-propanone IUPAC Name: 1-[4-[4-(4-bromobenzoyl)piperazin-1-yl]-3-fluorophenyl]propan-1-one Traditional Name: 1-[4-[4-(4-bromobenzoyl)piperazino]-3-fluoro-phenyl]propan-1-one Formula: C20H20BrFN2O2 MolecularWeight: 419.287403

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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=C3)Br)F

Isomeric SMILES

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

InChI

InChI=1S/C20H20BrFN2O2/c1-2-19(25)15-5-8-18(17(22)13-15)23-9-11-24(12-10-23)20(26)14-3-6-16(21)7-4-14/h3-8,13H,2,9-12H2,1H3