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

Systemtic Name: 1-(4-aminophenyl)-3-[4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium-1-yl]propan-1-one Openeye Name: 1-(4-aminophenyl)-3-[4-[(E)-cinnamyl]piperazin-4-ium-1-yl]propan-1-one CAS Name: 1-(4-aminophenyl)-3-[4-[(E)-3-phenylprop-2-enyl]-1-piperazin-4-iumyl]-1-propanone IUPAC Name: 1-(4-aminophenyl)-3-[4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium-1-yl]propan-1-one Traditional Name: 1-(4-aminophenyl)-3-[4-[(E)-cinnamyl]piperazin-4-ium-1-yl]propan-1-one Formula: C22H28N3O+ MolecularWeight: 350.47722

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC=CC2=CC=CC=C2)CCC(=O)C3=CC=C(C=C3)N

Isomeric SMILES

C1CN(CC[NH+]1C/C=C/C2=CC=CC=C2)CCC(=O)C3=CC=C(C=C3)N

InChI

InChI=1S/C22H27N3O/c23-21-10-8-20(9-11-21)22(26)12-14-25-17-15-24(16-18-25)13-4-7-19-5-2-1-3-6-19/h1-11H,12-18,23H2/p+1/b7-4+