2-ethanoyl-5-(2-ethylsulfanylpropyl)cyclohexane-1,3-dione

Systemtic Name: 2-ethanoyl-5-(2-ethylsulfanylpropyl)cyclohexane-1,3-dione Openeye Name: 2-acetyl-5-(2-ethylsulfanylpropyl)cyclohexane-1,3-dione CAS Name: 2-acetyl-5-[2-(ethylthio)propyl]cyclohexane-1,3-dione IUPAC Name: 2-acetyl-5-(2-ethylsulfanylpropyl)cyclohexane-1,3-dione Traditional Name: 2-acetyl-5-[2-(ethylthio)propyl]cyclohexane-1,3-quinone Formula: C13H20O3S MolecularWeight: 256.3611

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Descriptors Computed from Structure

Canonical SMILES:

CCSC(C)CC1CC(=O)C(C(=O)C1)C(=O)C

Isomeric SMILES

CCSC(C)CC1CC(=O)C(C(=O)C1)C(=O)C

InChI

InChI=1S/C13H20O3S/c1-4-17-8(2)5-10-6-11(15)13(9(3)14)12(16)7-10/h8,10,13H,4-7H2,1-3H3