N-(5-chloranyl-2-methoxy-phenyl)-2-[4-(4-ethanoylphenyl)piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-(5-chloranyl-2-methoxy-phenyl)-2-[4-(4-ethanoylphenyl)piperazin-1-ium-1-yl]ethanamide Openeye Name: 2-[4-(4-acetylphenyl)piperazin-1-ium-1-yl]-N-(5-chloro-2-methoxy-phenyl)acetamide CAS Name: 2-[4-(4-acetylphenyl)-1-piperazin-1-iumyl]-N-(5-chloro-2-methoxyphenyl)acetamide IUPAC Name: 2-[4-(4-acetylphenyl)piperazin-1-ium-1-yl]-N-(5-chloro-2-methoxyphenyl)acetamide Traditional Name: 2-[4-(4-acetylphenyl)piperazin-1-ium-1-yl]-N-(5-chloro-2-methoxy-phenyl)acetamide Formula: C21H25ClN3O3+ MolecularWeight: 402.8945

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H24ClN3O3/c1-15(26)16-3-6-18(7-4-16)25-11-9-24(10-12-25)14-21(27)23-19-13-17(22)5-8-20(19)28-2/h3-8,13H,9-12,14H2,1-2H3,(H,23,27)/p+1