4-(2-thiophen-2-ylsulfonylethoxy)benzoic acid

Systemtic Name: 4-(2-thiophen-2-ylsulfonylethoxy)benzoic acid Openeye Name: 4-[2-(2-thienylsulfonyl)ethoxy]benzoic acid CAS Name: 4-(2-thiophen-2-ylsulfonylethoxy)benzoic acid IUPAC Name: 4-(2-thiophen-2-ylsulfonylethoxy)benzoic acid Traditional Name: 4-[2-(2-thienylsulfonyl)ethoxy]benzoic acid Formula: C13H12O5S2 MolecularWeight: 312.36138

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)S(=O)(=O)CCOC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

C1=CSC(=C1)S(=O)(=O)CCOC2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C13H12O5S2/c14-13(15)10-3-5-11(6-4-10)18-7-9-20(16,17)12-2-1-8-19-12/h1-6,8H,7,9H2,(H,14,15)