2-[4-(2-methylphenyl)piperazin-1-ium-1-yl]ethanamide

Systemtic Name: 2-[4-(2-methylphenyl)piperazin-1-ium-1-yl]ethanamide Openeye Name: 2-[4-(o-tolyl)piperazin-1-ium-1-yl]acetamide CAS Name: 2-[4-(2-methylphenyl)-1-piperazin-1-iumyl]acetamide IUPAC Name: 2-[4-(2-methylphenyl)piperazin-1-ium-1-yl]acetamide Traditional Name: 2-[4-(o-tolyl)piperazin-1-ium-1-yl]acetamide Formula: C13H20N3O+ MolecularWeight: 234.3174

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2CC[NH+](CC2)CC(=O)N

Isomeric SMILES

CC1=CC=CC=C1N2CC[NH+](CC2)CC(=O)N

InChI

InChI=1S/C13H19N3O/c1-11-4-2-3-5-12(11)16-8-6-15(7-9-16)10-13(14)17/h2-5H,6-10H2,1H3,(H2,14,17)/p+1