(E)-3-(5-bromanyl-2-fluoranyl-phenyl)-1-[4-(3-methoxyphenyl)piperazin-1-yl]prop-2-en-1-one

Systemtic Name: (E)-3-(5-bromanyl-2-fluoranyl-phenyl)-1-[4-(3-methoxyphenyl)piperazin-1-yl]prop-2-en-1-one Openeye Name: (E)-3-(5-bromo-2-fluoro-phenyl)-1-[4-(3-methoxyphenyl)piperazin-1-yl]prop-2-en-1-one CAS Name: (E)-3-(5-bromo-2-fluorophenyl)-1-[4-(3-methoxyphenyl)-1-piperazinyl]-2-propen-1-one IUPAC Name: (E)-3-(5-bromo-2-fluorophenyl)-1-[4-(3-methoxyphenyl)piperazin-1-yl]prop-2-en-1-one Traditional Name: (E)-3-(5-bromo-2-fluoro-phenyl)-1-[4-(3-methoxyphenyl)piperazino]prop-2-en-1-one Formula: C20H20BrFN2O2 MolecularWeight: 419.287403

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2CCN(CC2)C(=O)C=CC3=C(C=CC(=C3)Br)F

Isomeric SMILES

COC1=CC=CC(=C1)N2CCN(CC2)C(=O)/C=C/C3=C(C=CC(=C3)Br)F

InChI

InChI=1S/C20H20BrFN2O2/c1-26-18-4-2-3-17(14-18)23-9-11-24(12-10-23)20(25)8-5-15-13-16(21)6-7-19(15)22/h2-8,13-14H,9-12H2,1H3/b8-5+