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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H25Cl2N3O3S/c1-13(2)5-6-20-17(23)12-21-7-9-22(10-8-21)26(24,25)14-3-4-15(18)16(19)11-14/h3-4,11,13H,5-10,12H2,1-2H3,(H,20,23)/p+1