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

Systemtic Name: N-(2-cyanoethyl)-N-methyl-2-[4-(2-methyl-2-phenyl-propanoyl)piperazin-1-ium-1-yl]ethanamide Openeye Name: N-(2-cyanoethyl)-N-methyl-2-[4-(2-methyl-2-phenyl-propanoyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-(2-cyanoethyl)-N-methyl-2-[4-(2-methyl-1-oxo-2-phenylpropyl)-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(2-cyanoethyl)-N-methyl-2-[4-(2-methyl-2-phenylpropanoyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-(2-cyanoethyl)-N-methyl-2-[4-(2-methyl-2-phenyl-propanoyl)piperazin-1-ium-1-yl]acetamide Formula: C20H29N4O2+ MolecularWeight: 357.46986

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H28N4O2/c1-20(2,17-8-5-4-6-9-17)19(26)24-14-12-23(13-15-24)16-18(25)22(3)11-7-10-21/h4-6,8-9H,7,11-16H2,1-3H3/p+1