1-(5-fluoranyl-1H-indol-3-yl)-2-[4-[(E)-3-phenylprop-2-enyl]piperazine-1,4-diium-1-yl]ethanone

Systemtic Name: 1-(5-fluoranyl-1H-indol-3-yl)-2-[4-[(E)-3-phenylprop-2-enyl]piperazine-1,4-diium-1-yl]ethanone Openeye Name: 2-[4-[(E)-cinnamyl]piperazine-1,4-diium-1-yl]-1-(5-fluoro-1H-indol-3-yl)ethanone CAS Name: 1-(5-fluoro-1H-indol-3-yl)-2-[4-[(E)-3-phenylprop-2-enyl]-1-piperazine-1,4-diiumyl]ethanone IUPAC Name: 1-(5-fluoro-1H-indol-3-yl)-2-[4-[(E)-3-phenylprop-2-enyl]piperazine-1,4-diium-1-yl]ethanone Traditional Name: 2-[4-[(E)-cinnamyl]piperazine-1,4-diium-1-yl]-1-(5-fluoro-1H-indol-3-yl)ethanone Formula: C23H26FN3O+2 MolecularWeight: 379.470443

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC[NH+]1CC=CC2=CC=CC=C2)CC(=O)C3=CNC4=C3C=C(C=C4)F

Isomeric SMILES

C1C[NH+](CC[NH+]1C/C=C/C2=CC=CC=C2)CC(=O)C3=CNC4=C3C=C(C=C4)F

InChI

InChI=1S/C23H24FN3O/c24-19-8-9-22-20(15-19)21(16-25-22)23(28)17-27-13-11-26(12-14-27)10-4-7-18-5-2-1-3-6-18/h1-9,15-16,25H,10-14,17H2/p+2/b7-4+