2-[4-(2-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-(3-ethylpent-1-yn-3-yl)ethanamide

Systemtic Name: 2-[4-(2-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-(3-ethylpent-1-yn-3-yl)ethanamide Openeye Name: 2-[4-(2-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-(1,1-diethylprop-2-ynyl)acetamide CAS Name: 2-[4-(2-chlorophenyl)sulfonyl-1-piperazin-1-iumyl]-N-(3-ethylpent-1-yn-3-yl)acetamide IUPAC Name: 2-[4-(2-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-(3-ethylpent-1-yn-3-yl)acetamide Traditional Name: 2-[4-(2-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-(1,1-diethylprop-2-ynyl)acetamide Formula: C19H27ClN3O3S+ MolecularWeight: 412.95398

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(C#C)NC(=O)C[NH+]1CCN(CC1)S(=O)(=O)C2=CC=CC=C2Cl

Isomeric SMILES

CCC(CC)(C#C)NC(=O)C[NH+]1CCN(CC1)S(=O)(=O)C2=CC=CC=C2Cl

InChI

InChI=1S/C19H26ClN3O3S/c1-4-19(5-2,6-3)21-18(24)15-22-11-13-23(14-12-22)27(25,26)17-10-8-7-9-16(17)20/h1,7-10H,5-6,11-15H2,2-3H3,(H,21,24)/p+1