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

Systemtic Name: 3-[1,1-bis(oxidanylidene)-2,3-dihydro-1-benzothiophen-2-yl]propanoic acid Openeye Name: 3-(1,1-dioxo-2,3-dihydrobenzothiophen-2-yl)propanoic acid CAS Name: 3-(1,1-dioxo-2,3-dihydro-1-benzothiophen-2-yl)propanoic acid IUPAC Name: 3-(1,1-dioxo-2,3-dihydro-1-benzothiophen-2-yl)propanoic acid Traditional Name: 3-(1,1-diketo-2,3-dihydrobenzothiophen-2-yl)propionic acid Formula: C11H12O4S MolecularWeight: 240.27558

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Descriptors Computed from Structure

Canonical SMILES:

C1C(S(=O)(=O)C2=CC=CC=C21)CCC(=O)O

Isomeric SMILES

C1C(S(=O)(=O)C2=CC=CC=C21)CCC(=O)O

InChI

InChI=1S/C11H12O4S/c12-11(13)6-5-9-7-8-3-1-2-4-10(8)16(9,14)15/h1-4,9H,5-7H2,(H,12,13)