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

Systemtic Name: 2-[4-(2-chlorophenyl)piperazin-1-ium-1-yl]-N-[4-(cyanomethyl)phenyl]ethanamide Openeye Name: 2-[4-(2-chlorophenyl)piperazin-1-ium-1-yl]-N-[4-(cyanomethyl)phenyl]acetamide CAS Name: 2-[4-(2-chlorophenyl)-1-piperazin-1-iumyl]-N-[4-(cyanomethyl)phenyl]acetamide IUPAC Name: 2-[4-(2-chlorophenyl)piperazin-1-ium-1-yl]-N-[4-(cyanomethyl)phenyl]acetamide Traditional Name: 2-[4-(2-chlorophenyl)piperazin-1-ium-1-yl]-N-[4-(cyanomethyl)phenyl]acetamide Formula: C20H22ClN4O+ MolecularWeight: 369.86788

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)NC2=CC=C(C=C2)CC#N)C3=CC=CC=C3Cl

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)NC2=CC=C(C=C2)CC#N)C3=CC=CC=C3Cl

InChI

InChI=1S/C20H21ClN4O/c21-18-3-1-2-4-19(18)25-13-11-24(12-14-25)15-20(26)23-17-7-5-16(6-8-17)9-10-22/h1-8H,9,11-15H2,(H,23,26)/p+1