2-[4-(4-ethanoylphenyl)piperazin-1-ium-1-yl]-N-[(3-methoxyphenyl)methyl]ethanamide

Systemtic Name: 2-[4-(4-ethanoylphenyl)piperazin-1-ium-1-yl]-N-[(3-methoxyphenyl)methyl]ethanamide Openeye Name: 2-[4-(4-acetylphenyl)piperazin-1-ium-1-yl]-N-[(3-methoxyphenyl)methyl]acetamide CAS Name: 2-[4-(4-acetylphenyl)-1-piperazin-1-iumyl]-N-[(3-methoxyphenyl)methyl]acetamide IUPAC Name: 2-[4-(4-acetylphenyl)piperazin-1-ium-1-yl]-N-[(3-methoxyphenyl)methyl]acetamide Traditional Name: 2-[4-(4-acetylphenyl)piperazin-1-ium-1-yl]-N-m-anisyl-acetamide Formula: C22H28N3O3+ MolecularWeight: 382.47602

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)N2CC[NH+](CC2)CC(=O)NCC3=CC(=CC=C3)OC

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)N2CC[NH+](CC2)CC(=O)NCC3=CC(=CC=C3)OC

InChI

InChI=1S/C22H27N3O3/c1-17(26)19-6-8-20(9-7-19)25-12-10-24(11-13-25)16-22(27)23-15-18-4-3-5-21(14-18)28-2/h3-9,14H,10-13,15-16H2,1-2H3,(H,23,27)/p+1