2-butanoyl-5-(2-ethylsulfanylpropyl)-4-methyl-cyclohexane-1,3-dione

Systemtic Name: 2-butanoyl-5-(2-ethylsulfanylpropyl)-4-methyl-cyclohexane-1,3-dione Openeye Name: 2-butanoyl-5-(2-ethylsulfanylpropyl)-4-methyl-cyclohexane-1,3-dione CAS Name: 5-[2-(ethylthio)propyl]-4-methyl-2-(1-oxobutyl)cyclohexane-1,3-dione IUPAC Name: 2-butanoyl-5-(2-ethylsulfanylpropyl)-4-methylcyclohexane-1,3-dione Traditional Name: 2-butyryl-5-[2-(ethylthio)propyl]-4-methyl-cyclohexane-1,3-quinone Formula: C16H26O3S MolecularWeight: 298.44084

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C1C(=O)CC(C(C1=O)C)CC(C)SCC

Isomeric SMILES

CCCC(=O)C1C(=O)CC(C(C1=O)C)CC(C)SCC

InChI

InChI=1S/C16H26O3S/c1-5-7-13(17)15-14(18)9-12(11(4)16(15)19)8-10(3)20-6-2/h10-12,15H,5-9H2,1-4H3