2-[4-(5-methylthiophen-2-yl)sulfonylpiperazin-1-ium-1-yl]ethanoate

Systemtic Name: 2-[4-(5-methylthiophen-2-yl)sulfonylpiperazin-1-ium-1-yl]ethanoate Openeye Name: 2-[4-[(5-methyl-2-thienyl)sulfonyl]piperazin-1-ium-1-yl]acetate CAS Name: 2-[4-[(5-methyl-2-thiophenyl)sulfonyl]-1-piperazin-1-iumyl]acetate IUPAC Name: 2-[4-(5-methylthiophen-2-yl)sulfonylpiperazin-1-ium-1-yl]acetate Traditional Name: 2-[4-[(5-methyl-2-thienyl)sulfonyl]piperazin-1-ium-1-yl]acetate Formula: C11H16N2O4S2 MolecularWeight: 304.38574

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)S(=O)(=O)N2CC[NH+](CC2)CC(=O)[O-]

Isomeric SMILES

CC1=CC=C(S1)S(=O)(=O)N2CC[NH+](CC2)CC(=O)[O-]

InChI

InChI=1S/C11H16N2O4S2/c1-9-2-3-11(18-9)19(16,17)13-6-4-12(5-7-13)8-10(14)15/h2-3H,4-8H2,1H3,(H,14,15)