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

Systemtic Name: 2-[4-[(4-chlorophenyl)methyl]piperazine-1,4-diium-1-yl]-N-phenethyl-ethanamide Openeye Name: 2-[4-[(4-chlorophenyl)methyl]piperazine-1,4-diium-1-yl]-N-phenethyl-acetamide CAS Name: 2-[4-[(4-chlorophenyl)methyl]-1-piperazine-1,4-diiumyl]-N-phenethylacetamide IUPAC Name: 2-[4-[(4-chlorophenyl)methyl]piperazine-1,4-diium-1-yl]-N-phenethylacetamide Traditional Name: 2-[4-(4-chlorobenzyl)piperazine-1,4-diium-1-yl]-N-phenethyl-acetamide Formula: C21H28ClN3O+2 MolecularWeight: 373.91952

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC[NH+]1CC2=CC=C(C=C2)Cl)CC(=O)NCCC3=CC=CC=C3

Isomeric SMILES

C1C[NH+](CC[NH+]1CC2=CC=C(C=C2)Cl)CC(=O)NCCC3=CC=CC=C3

InChI

InChI=1S/C21H26ClN3O/c22-20-8-6-19(7-9-20)16-24-12-14-25(15-13-24)17-21(26)23-11-10-18-4-2-1-3-5-18/h1-9H,10-17H2,(H,23,26)/p+2