2-(1-oxidanyl-4-sulfanyl-cyclohexa-2,4-dien-1-yl)ethanoate

Systemtic Name: 2-(1-oxidanyl-4-sulfanyl-cyclohexa-2,4-dien-1-yl)ethanoate Openeye Name: 2-(1-hydroxy-4-sulfanyl-cyclohexa-2,4-dien-1-yl)acetate CAS Name: 2-(1-hydroxy-4-mercapto-1-cyclohexa-2,4-dienyl)acetate IUPAC Name: 2-(1-hydroxy-4-sulfanylcyclohexa-2,4-dien-1-yl)acetate Traditional Name: 2-(1-hydroxy-4-mercapto-cyclohexa-2,4-dien-1-yl)acetate Formula: C8H9O3S- MolecularWeight: 185.22026

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Descriptors Computed from Structure

Canonical SMILES:

C1C=C(C=CC1(CC(=O)[O-])O)S

Isomeric SMILES

C1C=C(C=CC1(CC(=O)[O-])O)S

InChI

InChI=1S/C8H10O3S/c9-7(10)5-8(11)3-1-6(12)2-4-8/h1-3,11-12H,4-5H2,(H,9,10)/p-1