2-[4-(3,4-dichlorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-(2-methylbutan-2-yl)ethanamide

Systemtic Name: 2-[4-(3,4-dichlorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-(2-methylbutan-2-yl)ethanamide Openeye Name: 2-[4-(3,4-dichlorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-(1,1-dimethylpropyl)acetamide CAS Name: 2-[4-(3,4-dichlorophenyl)sulfonyl-1-piperazin-1-iumyl]-N-(2-methylbutan-2-yl)acetamide IUPAC Name: 2-[4-(3,4-dichlorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-(2-methylbutan-2-yl)acetamide Traditional Name: N-tert-amyl-2-[4-(3,4-dichlorophenyl)sulfonylpiperazin-1-ium-1-yl]acetamide Formula: C17H26Cl2N3O3S+ MolecularWeight: 423.37764

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)NC(=O)C[NH+]1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)Cl

Isomeric SMILES

CCC(C)(C)NC(=O)C[NH+]1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)Cl

InChI

InChI=1S/C17H25Cl2N3O3S/c1-4-17(2,3)20-16(23)12-21-7-9-22(10-8-21)26(24,25)13-5-6-14(18)15(19)11-13/h5-6,11H,4,7-10,12H2,1-3H3,(H,20,23)/p+1