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

Systemtic Name: 2-[4-(2-methylphenyl)piperazin-1-ium-1-yl]-N-(2,4,4-trimethylpentan-2-yl)ethanamide Openeye Name: 2-[4-(o-tolyl)piperazin-1-ium-1-yl]-N-(1,1,3,3-tetramethylbutyl)acetamide CAS Name: 2-[4-(2-methylphenyl)-1-piperazin-1-iumyl]-N-(2,4,4-trimethylpentan-2-yl)acetamide IUPAC Name: 2-[4-(2-methylphenyl)piperazin-1-ium-1-yl]-N-(2,4,4-trimethylpentan-2-yl)acetamide Traditional Name: 2-[4-(o-tolyl)piperazin-1-ium-1-yl]-N-(1,1,3,3-tetramethylbutyl)acetamide Formula: C21H36N3O+ MolecularWeight: 346.53004

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H35N3O/c1-17-9-7-8-10-18(17)24-13-11-23(12-14-24)15-19(25)22-21(5,6)16-20(2,3)4/h7-10H,11-16H2,1-6H3,(H,22,25)/p+1