1-(4-chlorophenyl)-3-[4-[(E)-3-phenylprop-2-enyl]piperazine-1,4-diium-1-yl]propan-1-one

Systemtic Name: 1-(4-chlorophenyl)-3-[4-[(E)-3-phenylprop-2-enyl]piperazine-1,4-diium-1-yl]propan-1-one Openeye Name: 1-(4-chlorophenyl)-3-[4-[(E)-cinnamyl]piperazine-1,4-diium-1-yl]propan-1-one CAS Name: 1-(4-chlorophenyl)-3-[4-[(E)-3-phenylprop-2-enyl]-1-piperazine-1,4-diiumyl]-1-propanone IUPAC Name: 1-(4-chlorophenyl)-3-[4-[(E)-3-phenylprop-2-enyl]piperazine-1,4-diium-1-yl]propan-1-one Traditional Name: 1-(4-chlorophenyl)-3-[4-[(E)-cinnamyl]piperazine-1,4-diium-1-yl]propan-1-one Formula: C22H27ClN2O+2 MolecularWeight: 370.91558

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC[NH+]1CCC(=O)C2=CC=C(C=C2)Cl)CC=CC3=CC=CC=C3

Isomeric SMILES

C1C[NH+](CC[NH+]1CCC(=O)C2=CC=C(C=C2)Cl)C/C=C/C3=CC=CC=C3

InChI

InChI=1S/C22H25ClN2O/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,12-18H2/p+2/b7-4+