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

Systemtic Name: 2-[4-(2-methylphenyl)piperazin-1-ium-1-yl]-N-propyl-ethanamide Openeye Name: 2-[4-(o-tolyl)piperazin-1-ium-1-yl]-N-propyl-acetamide CAS Name: 2-[4-(2-methylphenyl)-1-piperazin-1-iumyl]-N-propylacetamide IUPAC Name: 2-[4-(2-methylphenyl)piperazin-1-ium-1-yl]-N-propylacetamide Traditional Name: 2-[4-(o-tolyl)piperazin-1-ium-1-yl]-N-propyl-acetamide Formula: C16H26N3O+ MolecularWeight: 276.39714

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C[NH+]1CCN(CC1)C2=CC=CC=C2C

Isomeric SMILES

CCCNC(=O)C[NH+]1CCN(CC1)C2=CC=CC=C2C

InChI

InChI=1S/C16H25N3O/c1-3-8-17-16(20)13-18-9-11-19(12-10-18)15-7-5-4-6-14(15)2/h4-7H,3,8-13H2,1-2H3,(H,17,20)/p+1