2-[4-[(3-chlorophenyl)methyl]piperazine-1,4-diium-1-yl]-N-(2-cyanophenyl)ethanamide

Systemtic Name: 2-[4-[(3-chlorophenyl)methyl]piperazine-1,4-diium-1-yl]-N-(2-cyanophenyl)ethanamide Openeye Name: 2-[4-[(3-chlorophenyl)methyl]piperazine-1,4-diium-1-yl]-N-(2-cyanophenyl)acetamide CAS Name: 2-[4-[(3-chlorophenyl)methyl]-1-piperazine-1,4-diiumyl]-N-(2-cyanophenyl)acetamide IUPAC Name: 2-[4-[(3-chlorophenyl)methyl]piperazine-1,4-diium-1-yl]-N-(2-cyanophenyl)acetamide Traditional Name: 2-[4-(3-chlorobenzyl)piperazine-1,4-diium-1-yl]-N-(2-cyanophenyl)acetamide Formula: C20H23ClN4O+2 MolecularWeight: 370.87582

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC[NH+]1CC2=CC(=CC=C2)Cl)CC(=O)NC3=CC=CC=C3C#N

Isomeric SMILES

C1C[NH+](CC[NH+]1CC2=CC(=CC=C2)Cl)CC(=O)NC3=CC=CC=C3C#N

InChI

InChI=1S/C20H21ClN4O/c21-18-6-3-4-16(12-18)14-24-8-10-25(11-9-24)15-20(26)23-19-7-2-1-5-17(19)13-22/h1-7,12H,8-11,14-15H2,(H,23,26)/p+2