2-[4-(2-methylpropanoyl)piperazin-1-ium-1-yl]-N-phenyl-ethanamide

Systemtic Name: 2-[4-(2-methylpropanoyl)piperazin-1-ium-1-yl]-N-phenyl-ethanamide Openeye Name: 2-[4-(2-methylpropanoyl)piperazin-1-ium-1-yl]-N-phenyl-acetamide CAS Name: 2-[4-(2-methyl-1-oxopropyl)-1-piperazin-1-iumyl]-N-phenylacetamide IUPAC Name: 2-[4-(2-methylpropanoyl)piperazin-1-ium-1-yl]-N-phenylacetamide Traditional Name: 2-(4-isobutyrylpiperazin-1-ium-1-yl)-N-phenyl-acetamide Formula: C16H24N3O2+ MolecularWeight: 290.38066

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N1CC[NH+](CC1)CC(=O)NC2=CC=CC=C2

Isomeric SMILES

CC(C)C(=O)N1CC[NH+](CC1)CC(=O)NC2=CC=CC=C2

InChI

InChI=1S/C16H23N3O2/c1-13(2)16(21)19-10-8-18(9-11-19)12-15(20)17-14-6-4-3-5-7-14/h3-7,13H,8-12H2,1-2H3,(H,17,20)/p+1