2-(2-methoxy-4,5-dimethyl-phenyl)sulfanylethanoate

Systemtic Name: 2-(2-methoxy-4,5-dimethyl-phenyl)sulfanylethanoate Openeye Name: 2-(2-methoxy-4,5-dimethyl-phenyl)sulfanylacetate CAS Name: 2-[(2-methoxy-4,5-dimethylphenyl)thio]acetate IUPAC Name: 2-(2-methoxy-4,5-dimethylphenyl)sulfanylacetate Traditional Name: 2-[(2-methoxy-4,5-dimethyl-phenyl)thio]acetate Formula: C11H13O3S- MolecularWeight: 225.28412

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C)SCC(=O)[O-])OC

Isomeric SMILES

CC1=CC(=C(C=C1C)SCC(=O)[O-])OC

InChI

InChI=1S/C11H14O3S/c1-7-4-9(14-3)10(5-8(7)2)15-6-11(12)13/h4-5H,6H2,1-3H3,(H,12,13)/p-1