2-[5-(4-methylpiperazin-4-ium-1-yl)sulfonylthiophen-2-yl]ethanoate

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)S(=O)(=O)C2=CC=C(S2)CC(=O)[O-]

Isomeric SMILES

C[NH+]1CCN(CC1)S(=O)(=O)C2=CC=C(S2)CC(=O)[O-]

InChI

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