(3,5-dimethyl-4-oxidanyl-phenyl)methyl 2-sulfanylethanoate

Systemtic Name: (3,5-dimethyl-4-oxidanyl-phenyl)methyl 2-sulfanylethanoate Openeye Name: (4-hydroxy-3,5-dimethyl-phenyl)methyl 2-sulfanylacetate CAS Name: 2-mercaptoacetic acid (4-hydroxy-3,5-dimethylphenyl)methyl ester IUPAC Name: (4-hydroxy-3,5-dimethylphenyl)methyl 2-sulfanylacetate Traditional Name: 2-mercaptoacetic acid (4-hydroxy-3,5-dimethyl-benzyl) ester Formula: C11H14O3S MolecularWeight: 226.29206

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1O)C)COC(=O)CS

Isomeric SMILES

CC1=CC(=CC(=C1O)C)COC(=O)CS

InChI

InChI=1S/C11H14O3S/c1-7-3-9(4-8(2)11(7)13)5-14-10(12)6-15/h3-4,13,15H,5-6H2,1-2H3