methyl 2-(4-chloranyl-2,5-dimethyl-phenyl)sulfanylethanoate

Systemtic Name: methyl 2-(4-chloranyl-2,5-dimethyl-phenyl)sulfanylethanoate Openeye Name: methyl 2-(4-chloro-2,5-dimethyl-phenyl)sulfanylacetate CAS Name: 2-[(4-chloro-2,5-dimethylphenyl)thio]acetic acid methyl ester IUPAC Name: methyl 2-(4-chloro-2,5-dimethylphenyl)sulfanylacetate Traditional Name: 2-[(4-chloro-2,5-dimethyl-phenyl)thio]acetic acid methyl ester Formula: C11H13ClO2S MolecularWeight: 244.73772

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Cl)C)SCC(=O)OC

Isomeric SMILES

CC1=CC(=C(C=C1Cl)C)SCC(=O)OC

InChI

InChI=1S/C11H13ClO2S/c1-7-5-10(8(2)4-9(7)12)15-6-11(13)14-3/h4-5H,6H2,1-3H3