2-[4-(4-cyclohexylphenyl)sulfonylpiperazin-1-ium-1-yl]-N-(methylcarbamoyl)ethanamide

Systemtic Name: 2-[4-(4-cyclohexylphenyl)sulfonylpiperazin-1-ium-1-yl]-N-(methylcarbamoyl)ethanamide Openeye Name: 2-[4-(4-cyclohexylphenyl)sulfonylpiperazin-1-ium-1-yl]-N-(methylcarbamoyl)acetamide CAS Name: 2-[4-(4-cyclohexylphenyl)sulfonyl-1-piperazin-1-iumyl]-N-(methylcarbamoyl)acetamide IUPAC Name: 2-[4-(4-cyclohexylphenyl)sulfonylpiperazin-1-ium-1-yl]-N-(methylcarbamoyl)acetamide Traditional Name: 2-[4-(4-cyclohexylphenyl)sulfonylpiperazin-1-ium-1-yl]-N-(methylcarbamoyl)acetamide Formula: C20H31N4O4S+ MolecularWeight: 423.54954

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)NC(=O)C[NH+]1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C3CCCCC3

Isomeric SMILES

CNC(=O)NC(=O)C[NH+]1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C3CCCCC3

InChI

InChI=1S/C20H30N4O4S/c1-21-20(26)22-19(25)15-23-11-13-24(14-12-23)29(27,28)18-9-7-17(8-10-18)16-5-3-2-4-6-16/h7-10,16H,2-6,11-15H2,1H3,(H2,21,22,25,26)/p+1