2-[4-[2-(4-chloranyl-3-methyl-phenoxy)ethanoyl]piperazin-1-ium-1-yl]-N-(4-methylphenyl)ethanamide

Systemtic Name: 2-[4-[2-(4-chloranyl-3-methyl-phenoxy)ethanoyl]piperazin-1-ium-1-yl]-N-(4-methylphenyl)ethanamide Openeye Name: 2-[4-[2-(4-chloro-3-methyl-phenoxy)acetyl]piperazin-1-ium-1-yl]-N-(p-tolyl)acetamide CAS Name: 2-[4-[2-(4-chloro-3-methylphenoxy)-1-oxoethyl]-1-piperazin-1-iumyl]-N-(4-methylphenyl)acetamide IUPAC Name: 2-[4-[2-(4-chloro-3-methylphenoxy)acetyl]piperazin-1-ium-1-yl]-N-(4-methylphenyl)acetamide Traditional Name: 2-[4-[2-(4-chloro-3-methyl-phenoxy)acetyl]piperazin-1-ium-1-yl]-N-(p-tolyl)acetamide Formula: C22H27ClN3O3+ MolecularWeight: 416.92108

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C[NH+]2CCN(CC2)C(=O)COC3=CC(=C(C=C3)Cl)C

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)C[NH+]2CCN(CC2)C(=O)COC3=CC(=C(C=C3)Cl)C

InChI

InChI=1S/C22H26ClN3O3/c1-16-3-5-18(6-4-16)24-21(27)14-25-9-11-26(12-10-25)22(28)15-29-19-7-8-20(23)17(2)13-19/h3-8,13H,9-12,14-15H2,1-2H3,(H,24,27)/p+1