2-[4-(2,5-dimethylphenyl)piperazin-1-ium-1-yl]-N-(4-ethanoylphenyl)ethanamide

Systemtic Name: 2-[4-(2,5-dimethylphenyl)piperazin-1-ium-1-yl]-N-(4-ethanoylphenyl)ethanamide Openeye Name: N-(4-acetylphenyl)-2-[4-(2,5-dimethylphenyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-(4-acetylphenyl)-2-[4-(2,5-dimethylphenyl)-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(4-acetylphenyl)-2-[4-(2,5-dimethylphenyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-(4-acetylphenyl)-2-[4-(2,5-dimethylphenyl)piperazin-1-ium-1-yl]acetamide Formula: C22H28N3O2+ MolecularWeight: 366.47662

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N2CC[NH+](CC2)CC(=O)NC3=CC=C(C=C3)C(=O)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)N2CC[NH+](CC2)CC(=O)NC3=CC=C(C=C3)C(=O)C

InChI

InChI=1S/C22H27N3O2/c1-16-4-5-17(2)21(14-16)25-12-10-24(11-13-25)15-22(27)23-20-8-6-19(7-9-20)18(3)26/h4-9,14H,10-13,15H2,1-3H3,(H,23,27)/p+1