3-(thiophen-2-ylmethylsulfonyl)propanoic acid

Systemtic Name: 3-(thiophen-2-ylmethylsulfonyl)propanoic acid Openeye Name: 3-(2-thienylmethylsulfonyl)propanoic acid CAS Name: 3-(thiophen-2-ylmethylsulfonyl)propanoic acid IUPAC Name: 3-(thiophen-2-ylmethylsulfonyl)propanoic acid Traditional Name: 3-(2-thenylsulfonyl)propionic acid Formula: C8H10O4S2 MolecularWeight: 234.2926

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)CS(=O)(=O)CCC(=O)O

Isomeric SMILES

C1=CSC(=C1)CS(=O)(=O)CCC(=O)O

InChI

InChI=1S/C8H10O4S2/c9-8(10)3-5-14(11,12)6-7-2-1-4-13-7/h1-2,4H,3,5-6H2,(H,9,10)