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

Systemtic Name: 2-[4-[(4-methylphenyl)methyl]piperazine-1,4-diium-1-yl]ethanamide Openeye Name: 2-[4-(p-tolylmethyl)piperazine-1,4-diium-1-yl]acetamide CAS Name: 2-[4-[(4-methylphenyl)methyl]-1-piperazine-1,4-diiumyl]acetamide IUPAC Name: 2-[4-[(4-methylphenyl)methyl]piperazine-1,4-diium-1-yl]acetamide Traditional Name: 2-[4-(4-methylbenzyl)piperazine-1,4-diium-1-yl]acetamide Formula: C14H23N3O+2 MolecularWeight: 249.35192

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C[NH+]2CC[NH+](CC2)CC(=O)N

Isomeric SMILES

CC1=CC=C(C=C1)C[NH+]2CC[NH+](CC2)CC(=O)N

InChI

InChI=1S/C14H21N3O/c1-12-2-4-13(5-3-12)10-16-6-8-17(9-7-16)11-14(15)18/h2-5H,6-11H2,1H3,(H2,15,18)/p+2