methyl 2-(3,4-dimethylphenyl)sulfanylethanoate

Systemtic Name: methyl 2-(3,4-dimethylphenyl)sulfanylethanoate Openeye Name: methyl 2-(3,4-dimethylphenyl)sulfanylacetate CAS Name: 2-[(3,4-dimethylphenyl)thio]acetic acid methyl ester IUPAC Name: methyl 2-(3,4-dimethylphenyl)sulfanylacetate Traditional Name: 2-[(3,4-dimethylphenyl)thio]acetic acid methyl ester Formula: C11H14O2S MolecularWeight: 210.29266

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)SCC(=O)OC)C

Isomeric SMILES

CC1=C(C=C(C=C1)SCC(=O)OC)C

InChI

InChI=1S/C11H14O2S/c1-8-4-5-10(6-9(8)2)14-7-11(12)13-3/h4-6H,7H2,1-3H3