2-[[1,1-bis(oxidanylidene)-2,3-dihydro-1-benzothiophen-3-yl]sulfanyl]propanoic acid

Systemtic Name: 2-[[1,1-bis(oxidanylidene)-2,3-dihydro-1-benzothiophen-3-yl]sulfanyl]propanoic acid Openeye Name: 2-[(1,1-dioxo-2,3-dihydrobenzothiophen-3-yl)sulfanyl]propanoic acid CAS Name: 2-[(1,1-dioxo-2,3-dihydro-1-benzothiophen-3-yl)thio]propanoic acid IUPAC Name: 2-[(1,1-dioxo-2,3-dihydro-1-benzothiophen-3-yl)sulfanyl]propanoic acid Traditional Name: 2-[(1,1-diketo-2,3-dihydrobenzothiophen-3-yl)thio]propionic acid Formula: C11H12O4S2 MolecularWeight: 272.34058

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)SC1CS(=O)(=O)C2=CC=CC=C12

Isomeric SMILES

CC(C(=O)O)SC1CS(=O)(=O)C2=CC=CC=C12

InChI

InChI=1S/C11H12O4S2/c1-7(11(12)13)16-9-6-17(14,15)10-5-3-2-4-8(9)10/h2-5,7,9H,6H2,1H3,(H,12,13)