N-[2-(3-chlorophenyl)ethyl]-2-[4-(4-ethanoylphenyl)piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-[2-(3-chlorophenyl)ethyl]-2-[4-(4-ethanoylphenyl)piperazin-1-ium-1-yl]ethanamide Openeye Name: 2-[4-(4-acetylphenyl)piperazin-1-ium-1-yl]-N-[2-(3-chlorophenyl)ethyl]acetamide CAS Name: 2-[4-(4-acetylphenyl)-1-piperazin-1-iumyl]-N-[2-(3-chlorophenyl)ethyl]acetamide IUPAC Name: 2-[4-(4-acetylphenyl)piperazin-1-ium-1-yl]-N-[2-(3-chlorophenyl)ethyl]acetamide Traditional Name: 2-[4-(4-acetylphenyl)piperazin-1-ium-1-yl]-N-[2-(3-chlorophenyl)ethyl]acetamide Formula: C22H27ClN3O2+ MolecularWeight: 400.92168

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)N2CC[NH+](CC2)CC(=O)NCCC3=CC(=CC=C3)Cl

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)N2CC[NH+](CC2)CC(=O)NCCC3=CC(=CC=C3)Cl

InChI

InChI=1S/C22H26ClN3O2/c1-17(27)19-5-7-21(8-6-19)26-13-11-25(12-14-26)16-22(28)24-10-9-18-3-2-4-20(23)15-18/h2-8,15H,9-14,16H2,1H3,(H,24,28)/p+1