3-[[4-[(E)-3-phenylprop-2-enyl]piperazine-1,4-diium-1-yl]methyl]-1H-indole

Systemtic Name: 3-[[4-[(E)-3-phenylprop-2-enyl]piperazine-1,4-diium-1-yl]methyl]-1H-indole Openeye Name: 3-[[4-[(E)-cinnamyl]piperazine-1,4-diium-1-yl]methyl]-1H-indole CAS Name: 3-[[4-[(E)-3-phenylprop-2-enyl]-1-piperazine-1,4-diiumyl]methyl]-1H-indole IUPAC Name: 3-[[4-[(E)-3-phenylprop-2-enyl]piperazine-1,4-diium-1-yl]methyl]-1H-indole Traditional Name: 3-[[4-[(E)-cinnamyl]piperazine-1,4-diium-1-yl]methyl]-1H-indole Formula: C22H27N3+2 MolecularWeight: 333.46988

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC[NH+]1CC=CC2=CC=CC=C2)CC3=CNC4=CC=CC=C43

Isomeric SMILES

C1C[NH+](CC[NH+]1C/C=C/C2=CC=CC=C2)CC3=CNC4=CC=CC=C43

InChI

InChI=1S/C22H25N3/c1-2-7-19(8-3-1)9-6-12-24-13-15-25(16-14-24)18-20-17-23-22-11-5-4-10-21(20)22/h1-11,17,23H,12-16,18H2/p+2/b9-6+