methyl 2-(2-ethylsulfanylpropyl)-4,6-bis(oxidanylidene)cyclohexane-1-carboxylate

Systemtic Name: methyl 2-(2-ethylsulfanylpropyl)-4,6-bis(oxidanylidene)cyclohexane-1-carboxylate Openeye Name: methyl 2-(2-ethylsulfanylpropyl)-4,6-dioxo-cyclohexanecarboxylate CAS Name: 2-[2-(ethylthio)propyl]-4,6-dioxo-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl 2-(2-ethylsulfanylpropyl)-4,6-dioxocyclohexane-1-carboxylate Traditional Name: 2-[2-(ethylthio)propyl]-4,6-diketo-cyclohexanecarboxylic acid methyl ester Formula: C13H20O4S MolecularWeight: 272.3605

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Descriptors Computed from Structure

Canonical SMILES:

CCSC(C)CC1CC(=O)CC(=O)C1C(=O)OC

Isomeric SMILES

CCSC(C)CC1CC(=O)CC(=O)C1C(=O)OC

InChI

InChI=1S/C13H20O4S/c1-4-18-8(2)5-9-6-10(14)7-11(15)12(9)13(16)17-3/h8-9,12H,4-7H2,1-3H3