2-[4-(2-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-(2,5-dimethylphenyl)ethanamide

Systemtic Name: 2-[4-(2-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-(2,5-dimethylphenyl)ethanamide Openeye Name: 2-[4-(2-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-(2,5-dimethylphenyl)acetamide CAS Name: 2-[4-(2-chlorophenyl)sulfonyl-1-piperazin-1-iumyl]-N-(2,5-dimethylphenyl)acetamide IUPAC Name: 2-[4-(2-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-(2,5-dimethylphenyl)acetamide Traditional Name: 2-[4-(2-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-(2,5-dimethylphenyl)acetamide Formula: C20H25ClN3O3S+ MolecularWeight: 422.9488

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=O)C[NH+]2CCN(CC2)S(=O)(=O)C3=CC=CC=C3Cl

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=O)C[NH+]2CCN(CC2)S(=O)(=O)C3=CC=CC=C3Cl

InChI

InChI=1S/C20H24ClN3O3S/c1-15-7-8-16(2)18(13-15)22-20(25)14-23-9-11-24(12-10-23)28(26,27)19-6-4-3-5-17(19)21/h3-8,13H,9-12,14H2,1-2H3,(H,22,25)/p+1