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N-prop-2-ynyl-2-[4-(2,3,5,6-tetramethylphenyl)sulfonylpiperazin-1-ium-1-yl]ethanamide

N-prop-2-ynyl-2-[4-(2,3,5,6-tetramethylphenyl)sulfonylpiperazin-1-ium-1-yl]ethanamide

Systemtic Name:N-prop-2-ynyl-2-[4-(2,3,5,6-tetramethylphenyl)sulfonylpiperazin-1-ium-1-yl]ethanamide
Openeye Name:N-prop-2-ynyl-2-[4-(2,3,5,6-tetramethylphenyl)sulfonylpiperazin-1-ium-1-yl]acetamide
CAS Name:N-prop-2-ynyl-2-[4-(2,3,5,6-tetramethylphenyl)sulfonyl-1-piperazin-1-iumyl]acetamide
IUPAC Name:N-prop-2-ynyl-2-[4-(2,3,5,6-tetramethylphenyl)sulfonylpiperazin-1-ium-1-yl]acetamide
Traditional Name:N-propargyl-2-[4-(2,3,5,6-tetramethylphenyl)sulfonylpiperazin-1-ium-1-yl]acetamide
Formula: C19H28N3O3S+
MolecularWeight: 378.50892
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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1C)S(=O)(=O)N2CC[NH+](CC2)CC(=O)NCC#C)C)C


Isomeric SMILES

CC1=CC(=C(C(=C1C)S(=O)(=O)N2CC[NH+](CC2)CC(=O)NCC#C)C)C


InChI

InChI=1S/C19H27N3O3S/c1-6-7-20-18(23)13-21-8-10-22(11-9-21)26(24,25)19-16(4)14(2)12-15(3)17(19)5/h1,12H,7-11,13H2,2-5H3,(H,20,23)/p+1


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