2-[2,5-bis(oxidanylidene)cyclohex-3-en-1-yl]sulfanylethanoic acid

Systemtic Name: 2-[2,5-bis(oxidanylidene)cyclohex-3-en-1-yl]sulfanylethanoic acid Openeye Name: 2-(2,5-dioxocyclohex-3-en-1-yl)sulfanylacetic acid CAS Name: 2-[(2,5-dioxo-1-cyclohex-3-enyl)thio]acetic acid IUPAC Name: 2-(2,5-dioxocyclohex-3-en-1-yl)sulfanylacetic acid Traditional Name: 2-[(2,5-diketocyclohex-3-en-1-yl)thio]acetic acid Formula: C8H8O4S MolecularWeight: 200.21172

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(=O)C=CC1=O)SCC(=O)O

Isomeric SMILES

C1C(C(=O)C=CC1=O)SCC(=O)O

InChI

InChI=1S/C8H8O4S/c9-5-1-2-6(10)7(3-5)13-4-8(11)12/h1-2,7H,3-4H2,(H,11,12)