1-[(E)-3-phenylprop-2-enyl]-4-(3-phenylprop-2-ynyl)piperazine-1,4-diium dichloride

Systemtic Name: 1-[(E)-3-phenylprop-2-enyl]-4-(3-phenylprop-2-ynyl)piperazine-1,4-diium dichloride Openeye Name: 1-[(E)-cinnamyl]-4-(3-phenylprop-2-ynyl)piperazine-1,4-diium dichloride CAS Name: 1-[(E)-3-phenylprop-2-enyl]-4-(3-phenylprop-2-ynyl)piperazine-1,4-diium dichloride IUPAC Name: 1-[(E)-3-phenylprop-2-enyl]-4-(3-phenylprop-2-ynyl)piperazine-1,4-diium dichloride Traditional Name: 1-[(E)-cinnamyl]-4-(3-phenylprop-2-ynyl)piperazine-1,4-diium dichloride Formula: C22H26Cl2N2 MolecularWeight: 389.36124

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC[NH+]1CC=CC2=CC=CC=C2)CC#CC3=CC=CC=C3.[Cl-].[Cl-]

Isomeric SMILES

C1C[NH+](CC[NH+]1C/C=C/C2=CC=CC=C2)CC#CC3=CC=CC=C3.[Cl-].[Cl-]

InChI

InChI=1S/C22H24N2.2ClH/c1-3-9-21(10-4-1)13-7-15-23-17-19-24(20-18-23)16-8-14-22-11-5-2-6-12-22;;/h1-7,9-13H,15-20H2;2*1H/b13-7+;;