2-(2-methyl-4-sulfanyl-phenoxy)ethanoate

Systemtic Name: 2-(2-methyl-4-sulfanyl-phenoxy)ethanoate Openeye Name: 2-(2-methyl-4-sulfanyl-phenoxy)acetate CAS Name: 2-(4-mercapto-2-methylphenoxy)acetate IUPAC Name: 2-(2-methyl-4-sulfanylphenoxy)acetate Traditional Name: 2-(4-mercapto-2-methyl-phenoxy)acetate Formula: C9H9O3S- MolecularWeight: 197.23096

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)S)OCC(=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)S)OCC(=O)[O-]

InChI

InChI=1S/C9H10O3S/c1-6-4-7(13)2-3-8(6)12-5-9(10)11/h2-4,13H,5H2,1H3,(H,10,11)/p-1