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

Systemtic Name: 2-[4-[2-(4-chloranyl-3-methyl-phenoxy)ethanoyl]piperazin-1-ium-1-yl]-N-(2-ethylphenyl)ethanamide Openeye Name: 2-[4-[2-(4-chloro-3-methyl-phenoxy)acetyl]piperazin-1-ium-1-yl]-N-(2-ethylphenyl)acetamide CAS Name: 2-[4-[2-(4-chloro-3-methylphenoxy)-1-oxoethyl]-1-piperazin-1-iumyl]-N-(2-ethylphenyl)acetamide IUPAC Name: 2-[4-[2-(4-chloro-3-methylphenoxy)acetyl]piperazin-1-ium-1-yl]-N-(2-ethylphenyl)acetamide Traditional Name: 2-[4-[2-(4-chloro-3-methyl-phenoxy)acetyl]piperazin-1-ium-1-yl]-N-(2-ethylphenyl)acetamide Formula: C23H29ClN3O3+ MolecularWeight: 430.94766

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)C[NH+]2CCN(CC2)C(=O)COC3=CC(=C(C=C3)Cl)C

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)C[NH+]2CCN(CC2)C(=O)COC3=CC(=C(C=C3)Cl)C

InChI

InChI=1S/C23H28ClN3O3/c1-3-18-6-4-5-7-21(18)25-22(28)15-26-10-12-27(13-11-26)23(29)16-30-19-8-9-20(24)17(2)14-19/h4-9,14H,3,10-13,15-16H2,1-2H3,(H,25,28)/p+1