3,3-dimethyl-2-(2-oxidanylidenebutyl)thian-4-one

Systemtic Name: 3,3-dimethyl-2-(2-oxidanylidenebutyl)thian-4-one Openeye Name: 3,3-dimethyl-2-(2-oxobutyl)tetrahydrothiopyran-4-one CAS Name: 3,3-dimethyl-2-(2-oxobutyl)-4-thianone IUPAC Name: 3,3-dimethyl-2-(2-oxobutyl)thian-4-one Traditional Name: 2-(2-ketobutyl)-3,3-dimethyl-tetrahydrothiopyran-4-one Formula: C11H18O2S MolecularWeight: 214.32442

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)CC1C(C(=O)CCS1)(C)C

Isomeric SMILES

CCC(=O)CC1C(C(=O)CCS1)(C)C

InChI

InChI=1S/C11H18O2S/c1-4-8(12)7-10-11(2,3)9(13)5-6-14-10/h10H,4-7H2,1-3H3