1-[4-[(E)-3-(5-bromanyl-2-fluoranyl-phenyl)prop-2-enoyl]piperazin-1-yl]-2-methyl-propan-1-one

Systemtic Name: 1-[4-[(E)-3-(5-bromanyl-2-fluoranyl-phenyl)prop-2-enoyl]piperazin-1-yl]-2-methyl-propan-1-one Openeye Name: 1-[4-[(E)-3-(5-bromo-2-fluoro-phenyl)prop-2-enoyl]piperazin-1-yl]-2-methyl-propan-1-one CAS Name: 1-[4-[(E)-3-(5-bromo-2-fluorophenyl)-1-oxoprop-2-enyl]-1-piperazinyl]-2-methyl-1-propanone IUPAC Name: 1-[4-[(E)-3-(5-bromo-2-fluorophenyl)prop-2-enoyl]piperazin-1-yl]-2-methylpropan-1-one Traditional Name: 1-[4-[(E)-3-(5-bromo-2-fluoro-phenyl)acryloyl]piperazino]-2-methyl-propan-1-one Formula: C17H20BrFN2O2 MolecularWeight: 383.255303

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N1CCN(CC1)C(=O)C=CC2=C(C=CC(=C2)Br)F

Isomeric SMILES

CC(C)C(=O)N1CCN(CC1)C(=O)/C=C/C2=C(C=CC(=C2)Br)F

InChI

InChI=1S/C17H20BrFN2O2/c1-12(2)17(23)21-9-7-20(8-10-21)16(22)6-3-13-11-14(18)4-5-15(13)19/h3-6,11-12H,7-10H2,1-2H3/b6-3+