N-(3-chloranyl-4-cyano-phenyl)-2-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-(3-chloranyl-4-cyano-phenyl)-2-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]ethanamide Openeye Name: N-(3-chloro-4-cyano-phenyl)-2-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-(3-chloro-4-cyanophenyl)-2-[4-(3-chlorophenyl)-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(3-chloro-4-cyanophenyl)-2-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-(3-chloro-4-cyano-phenyl)-2-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]acetamide Formula: C19H19Cl2N4O+ MolecularWeight: 390.28636

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H18Cl2N4O/c20-15-2-1-3-17(10-15)25-8-6-24(7-9-25)13-19(26)23-16-5-4-14(12-22)18(21)11-16/h1-5,10-11H,6-9,13H2,(H,23,26)/p+1