1-[(2R)-1-(2-fluorophenyl)propan-2-yl]-4-[(E)-3-phenylprop-2-enyl]piperazin-1-ium

Systemtic Name: 1-[(2R)-1-(2-fluorophenyl)propan-2-yl]-4-[(E)-3-phenylprop-2-enyl]piperazin-1-ium Openeye Name: 1-[(E)-cinnamyl]-4-[(1R)-2-(2-fluorophenyl)-1-methyl-ethyl]piperazin-4-ium CAS Name: 1-[(2R)-1-(2-fluorophenyl)propan-2-yl]-4-[(E)-3-phenylprop-2-enyl]piperazin-1-ium IUPAC Name: 1-[(2R)-1-(2-fluorophenyl)propan-2-yl]-4-[(E)-3-phenylprop-2-enyl]piperazin-1-ium Traditional Name: 1-[(E)-cinnamyl]-4-[(1R)-2-(2-fluorophenyl)-1-methyl-ethyl]piperazin-4-ium Formula: C22H28FN2+ MolecularWeight: 339.469523

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC=CC=C1F)[NH+]2CCN(CC2)CC=CC3=CC=CC=C3

Isomeric SMILES

C[C@H](CC1=CC=CC=C1F)[NH+]2CCN(CC2)C/C=C/C3=CC=CC=C3

InChI

InChI=1S/C22H27FN2/c1-19(18-21-11-5-6-12-22(21)23)25-16-14-24(15-17-25)13-7-10-20-8-3-2-4-9-20/h2-12,19H,13-18H2,1H3/p+1/b10-7+/t19-/m1/s1