methyl 4-methylsulfanylbenzoate

Systemtic Name: methyl 4-methylsulfanylbenzoate Openeye Name: methyl 4-methylsulfanylbenzoate CAS Name: 4-(methylthio)benzoic acid methyl ester IUPAC Name: methyl 4-methylsulfanylbenzoate Traditional Name: 4-(methylthio)benzoic acid methyl ester Formula: C9H10O2S MolecularWeight: 182.2395

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)SC

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)SC

InChI

InChI=1S/C9H10O2S/c1-11-9(10)7-3-5-8(12-2)6-4-7/h3-6H,1-2H3