methyl 3-(2-sulfanylethyl)benzoate

Systemtic Name: methyl 3-(2-sulfanylethyl)benzoate Openeye Name: methyl 3-(2-sulfanylethyl)benzoate CAS Name: 3-(2-mercaptoethyl)benzoic acid methyl ester IUPAC Name: methyl 3-(2-sulfanylethyl)benzoate Traditional Name: 3-(2-mercaptoethyl)benzoic acid methyl ester Formula: C10H12O2S MolecularWeight: 196.26608

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)CCS

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)CCS

InChI

InChI=1S/C10H12O2S/c1-12-10(11)9-4-2-3-8(7-9)5-6-13/h2-4,7,13H,5-6H2,1H3