2-[2-[3-(2-sulfonatoethyl)thiophen-2-yl]thiophen-3-yl]ethanesulfonate

Systemtic Name: 2-[2-[3-(2-sulfonatoethyl)thiophen-2-yl]thiophen-3-yl]ethanesulfonate Openeye Name: 2-[2-[3-(2-sulfonatoethyl)-2-thienyl]-3-thienyl]ethanesulfonate CAS Name: 2-[2-[3-(2-sulfonatoethyl)-2-thiophenyl]-3-thiophenyl]ethanesulfonate IUPAC Name: 2-[2-[3-(2-sulfonatoethyl)thiophen-2-yl]thiophen-3-yl]ethanesulfonate Traditional Name: 2-[2-[3-(2-sulfonatoethyl)-2-thienyl]-3-thienyl]ethanesulfonate Formula: C12H12O6S4-2 MolecularWeight: 380.48008

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1CCS(=O)(=O)[O-])C2=C(C=CS2)CCS(=O)(=O)[O-]

Isomeric SMILES

C1=CSC(=C1CCS(=O)(=O)[O-])C2=C(C=CS2)CCS(=O)(=O)[O-]

InChI

InChI=1S/C12H14O6S4/c13-21(14,15)7-3-9-1-5-19-11(9)12-10(2-6-20-12)4-8-22(16,17)18/h1-2,5-6H,3-4,7-8H2,(H,13,14,15)(H,16,17,18)/p-2