2-[3,3-bis(oxidanyl)propylsulfanyl]cyclohexa-2,5-diene-1,4-dione

Systemtic Name: 2-[3,3-bis(oxidanyl)propylsulfanyl]cyclohexa-2,5-diene-1,4-dione Openeye Name: 2-(3,3-dihydroxypropylsulfanyl)-1,4-benzoquinone CAS Name: 2-(3,3-dihydroxypropylthio)cyclohexa-2,5-diene-1,4-dione IUPAC Name: 2-(3,3-dihydroxypropylsulfanyl)cyclohexa-2,5-diene-1,4-dione Traditional Name: 2-(3,3-dihydroxypropylthio)-p-benzoquinone Formula: C9H10O4S MolecularWeight: 214.2383

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=O)C(=CC1=O)SCCC(O)O

Isomeric SMILES

C1=CC(=O)C(=CC1=O)SCCC(O)O

InChI

InChI=1S/C9H10O4S/c10-6-1-2-7(11)8(5-6)14-4-3-9(12)13/h1-2,5,9,12-13H,3-4H2