N-(2-cyanoethyl)-2-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]-N-(4-methylphenyl)ethanamide

Systemtic Name: N-(2-cyanoethyl)-2-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]-N-(4-methylphenyl)ethanamide Openeye Name: N-(2-cyanoethyl)-2-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]-N-(p-tolyl)acetamide CAS Name: N-(2-cyanoethyl)-2-[4-(4-methoxyphenyl)-1-piperazin-1-iumyl]-N-(4-methylphenyl)acetamide IUPAC Name: N-(2-cyanoethyl)-2-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]-N-(4-methylphenyl)acetamide Traditional Name: N-(2-cyanoethyl)-2-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]-N-(p-tolyl)acetamide Formula: C23H29N4O2+ MolecularWeight: 393.50196

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N(CCC#N)C(=O)C[NH+]2CCN(CC2)C3=CC=C(C=C3)OC

Isomeric SMILES

CC1=CC=C(C=C1)N(CCC#N)C(=O)C[NH+]2CCN(CC2)C3=CC=C(C=C3)OC

InChI

InChI=1S/C23H28N4O2/c1-19-4-6-21(7-5-19)27(13-3-12-24)23(28)18-25-14-16-26(17-15-25)20-8-10-22(29-2)11-9-20/h4-11H,3,13-18H2,1-2H3/p+1