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

Systemtic Name: N-[2-(3-chlorophenyl)ethyl]-2-[4-(phenylmethyl)piperazin-1-ium-1-yl]ethanamide Openeye Name: 2-(4-benzylpiperazin-1-ium-1-yl)-N-[2-(3-chlorophenyl)ethyl]acetamide CAS Name: N-[2-(3-chlorophenyl)ethyl]-2-[4-(phenylmethyl)-1-piperazin-1-iumyl]acetamide IUPAC Name: 2-(4-benzylpiperazin-1-ium-1-yl)-N-[2-(3-chlorophenyl)ethyl]acetamide Traditional Name: 2-(4-benzylpiperazin-1-ium-1-yl)-N-[2-(3-chlorophenyl)ethyl]acetamide Formula: C21H27ClN3O+ MolecularWeight: 372.91158

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)NCCC2=CC(=CC=C2)Cl)CC3=CC=CC=C3

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)NCCC2=CC(=CC=C2)Cl)CC3=CC=CC=C3

InChI

InChI=1S/C21H26ClN3O/c22-20-8-4-7-18(15-20)9-10-23-21(26)17-25-13-11-24(12-14-25)16-19-5-2-1-3-6-19/h1-8,15H,9-14,16-17H2,(H,23,26)/p+1