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

Systemtic Name: 2-[4-[(3-chlorophenyl)methyl]piperazine-1,4-diium-1-yl]ethanamide Openeye Name: 2-[4-[(3-chlorophenyl)methyl]piperazine-1,4-diium-1-yl]acetamide CAS Name: 2-[4-[(3-chlorophenyl)methyl]-1-piperazine-1,4-diiumyl]acetamide IUPAC Name: 2-[4-[(3-chlorophenyl)methyl]piperazine-1,4-diium-1-yl]acetamide Traditional Name: 2-[4-(3-chlorobenzyl)piperazine-1,4-diium-1-yl]acetamide Formula: C13H20ClN3O+2 MolecularWeight: 269.7704

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H18ClN3O/c14-12-3-1-2-11(8-12)9-16-4-6-17(7-5-16)10-13(15)18/h1-3,8H,4-7,9-10H2,(H2,15,18)/p+2