4-oxidanyl-5-sulfanyl-cyclohexa-2,4-dien-1-one

Systemtic Name: 4-oxidanyl-5-sulfanyl-cyclohexa-2,4-dien-1-one Openeye Name: 4-hydroxy-5-sulfanyl-cyclohexa-2,4-dien-1-one CAS Name: 4-hydroxy-5-mercapto-1-cyclohexa-2,4-dienone IUPAC Name: 4-hydroxy-5-sulfanylcyclohexa-2,4-dien-1-one Traditional Name: 4-hydroxy-5-mercapto-cyclohexa-2,4-dien-1-one Formula: C6H6O2S MolecularWeight: 142.17564

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)C=CC(=C1S)O

Isomeric SMILES

C1C(=O)C=CC(=C1S)O

InChI

InChI=1S/C6H6O2S/c7-4-1-2-5(8)6(9)3-4/h1-2,8-9H,3H2