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

Systemtic Name: 2-[4-(phenylcarbonyl)piperazin-1-ium-1-yl]-N-(2,4,4-trimethylpentan-2-yl)ethanamide Openeye Name: 2-(4-benzoylpiperazin-1-ium-1-yl)-N-(1,1,3,3-tetramethylbutyl)acetamide CAS Name: 2-(4-benzoyl-1-piperazin-1-iumyl)-N-(2,4,4-trimethylpentan-2-yl)acetamide IUPAC Name: 2-(4-benzoylpiperazin-1-ium-1-yl)-N-(2,4,4-trimethylpentan-2-yl)acetamide Traditional Name: 2-(4-benzoylpiperazin-1-ium-1-yl)-N-(1,1,3,3-tetramethylbutyl)acetamide Formula: C21H34N3O2+ MolecularWeight: 360.51356

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H33N3O2/c1-20(2,3)16-21(4,5)22-18(25)15-23-11-13-24(14-12-23)19(26)17-9-7-6-8-10-17/h6-10H,11-16H2,1-5H3,(H,22,25)/p+1