N-(2-chlorophenyl)-2-[4-(3,3-dimethylbutanoyl)piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-(2-chlorophenyl)-2-[4-(3,3-dimethylbutanoyl)piperazin-1-ium-1-yl]ethanamide Openeye Name: N-(2-chlorophenyl)-2-[4-(3,3-dimethylbutanoyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-(2-chlorophenyl)-2-[4-(3,3-dimethyl-1-oxobutyl)-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(2-chlorophenyl)-2-[4-(3,3-dimethylbutanoyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-(2-chlorophenyl)-2-[4-(3,3-dimethylbutanoyl)piperazin-1-ium-1-yl]acetamide Formula: C18H27ClN3O2+ MolecularWeight: 352.87888

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(=O)N1CC[NH+](CC1)CC(=O)NC2=CC=CC=C2Cl

Isomeric SMILES

CC(C)(C)CC(=O)N1CC[NH+](CC1)CC(=O)NC2=CC=CC=C2Cl

InChI

InChI=1S/C18H26ClN3O2/c1-18(2,3)12-17(24)22-10-8-21(9-11-22)13-16(23)20-15-7-5-4-6-14(15)19/h4-7H,8-13H2,1-3H3,(H,20,23)/p+1