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2-butanoyl-5-(thian-3-yl)cyclohexane-1,3-dione

2-butanoyl-5-(thian-3-yl)cyclohexane-1,3-dione

Systemtic Name:2-butanoyl-5-(thian-3-yl)cyclohexane-1,3-dione
Openeye Name:2-butanoyl-5-tetrahydrothiopyran-3-yl-cyclohexane-1,3-dione
CAS Name:2-(1-oxobutyl)-5-(3-thianyl)cyclohexane-1,3-dione
IUPAC Name:2-butanoyl-5-(thian-3-yl)cyclohexane-1,3-dione
Traditional Name:2-butyryl-5-tetrahydrothiopyran-3-yl-cyclohexane-1,3-quinone
Formula: C15H22O3S
MolecularWeight: 282.39838
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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C1C(=O)CC(CC1=O)C2CCCSC2


Isomeric SMILES

CCCC(=O)C1C(=O)CC(CC1=O)C2CCCSC2


InChI

InChI=1S/C15H22O3S/c1-2-4-12(16)15-13(17)7-11(8-14(15)18)10-5-3-6-19-9-10/h10-11,15H,2-9H2,1H3


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