methyl 6-methylsulfanylcyclohexa-1,5-diene-1-carboxylate

Systemtic Name: methyl 6-methylsulfanylcyclohexa-1,5-diene-1-carboxylate Openeye Name: methyl 6-methylsulfanylcyclohexa-1,5-diene-1-carboxylate CAS Name: 6-(methylthio)-1-cyclohexa-1,5-dienecarboxylic acid methyl ester IUPAC Name: methyl 6-methylsulfanylcyclohexa-1,5-diene-1-carboxylate Traditional Name: 6-(methylthio)cyclohexa-1,5-diene-1-carboxylic acid methyl ester Formula: C9H12O2S MolecularWeight: 184.25538

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CCCC=C1SC

Isomeric SMILES

COC(=O)C1=CCCC=C1SC

InChI

InChI=1S/C9H12O2S/c1-11-9(10)7-5-3-4-6-8(7)12-2/h5-6H,3-4H2,1-2H3