methyl 5-cyclohexylcarbonylsulfanylcyclohexa-1,5-diene-1-carboxylate

Systemtic Name: methyl 5-cyclohexylcarbonylsulfanylcyclohexa-1,5-diene-1-carboxylate Openeye Name: methyl 5-(cyclohexanecarbonylsulfanyl)cyclohexa-1,5-diene-1-carboxylate CAS Name: 5-[[cyclohexyl(oxo)methyl]thio]-1-cyclohexa-1,5-dienecarboxylic acid methyl ester IUPAC Name: methyl 5-(cyclohexanecarbonylsulfanyl)cyclohexa-1,5-diene-1-carboxylate Traditional Name: 5-(cyclohexanecarbonylthio)cyclohexa-1,5-diene-1-carboxylic acid methyl ester Formula: C15H20O3S MolecularWeight: 280.3825

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CCCC(=C1)SC(=O)C2CCCCC2

Isomeric SMILES

COC(=O)C1=CCCC(=C1)SC(=O)C2CCCCC2

InChI

InChI=1S/C15H20O3S/c1-18-14(16)12-8-5-9-13(10-12)19-15(17)11-6-3-2-4-7-11/h8,10-11H,2-7,9H2,1H3