methyl 5-ethanethioyl-2-methyl-benzoate

Systemtic Name: methyl 5-ethanethioyl-2-methyl-benzoate Openeye Name: methyl 5-ethanethioyl-2-methyl-benzoate CAS Name: 2-methyl-5-(1-sulfanylideneethyl)benzoic acid methyl ester IUPAC Name: methyl 5-ethanethioyl-2-methylbenzoate Traditional Name: 2-methyl-5-thioacetyl-benzoic acid methyl ester Formula: C11H12O2S MolecularWeight: 208.27678

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H12O2S/c1-7-4-5-9(8(2)14)6-10(7)11(12)13-3/h4-6H,1-3H3