2-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-ium-1-yl]-N-(2-cyanoethyl)-N-(2-methoxyphenyl)ethanamide

Systemtic Name: 2-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-ium-1-yl]-N-(2-cyanoethyl)-N-(2-methoxyphenyl)ethanamide Openeye Name: 2-[4-(5-chloro-2-methyl-phenyl)piperazin-1-ium-1-yl]-N-(2-cyanoethyl)-N-(2-methoxyphenyl)acetamide CAS Name: 2-[4-(5-chloro-2-methylphenyl)-1-piperazin-1-iumyl]-N-(2-cyanoethyl)-N-(2-methoxyphenyl)acetamide IUPAC Name: 2-[4-(5-chloro-2-methylphenyl)piperazin-1-ium-1-yl]-N-(2-cyanoethyl)-N-(2-methoxyphenyl)acetamide Traditional Name: 2-[4-(5-chloro-2-methyl-phenyl)piperazin-1-ium-1-yl]-N-(2-cyanoethyl)-N-(2-methoxyphenyl)acetamide Formula: C23H28ClN4O2+ MolecularWeight: 427.94702

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)N2CC[NH+](CC2)CC(=O)N(CCC#N)C3=CC=CC=C3OC

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)N2CC[NH+](CC2)CC(=O)N(CCC#N)C3=CC=CC=C3OC

InChI

InChI=1S/C23H27ClN4O2/c1-18-8-9-19(24)16-21(18)27-14-12-26(13-15-27)17-23(29)28(11-5-10-25)20-6-3-4-7-22(20)30-2/h3-4,6-9,16H,5,11-15,17H2,1-2H3/p+1