5-hexyl-4-methoxy-5-methyl-thiophen-2-one

Systemtic Name: 5-hexyl-4-methoxy-5-methyl-thiophen-2-one Openeye Name: 5-hexyl-4-methoxy-5-methyl-thiophen-2-one CAS Name: 5-hexyl-4-methoxy-5-methyl-2-thiophenone IUPAC Name: 5-hexyl-4-methoxy-5-methylthiophen-2-one Traditional Name: 5-hexyl-4-methoxy-5-methyl-thiophen-2-one Formula: C12H20O2S MolecularWeight: 228.351

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1(C(=CC(=O)S1)OC)C

Isomeric SMILES

CCCCCCC1(C(=CC(=O)S1)OC)C

InChI

InChI=1S/C12H20O2S/c1-4-5-6-7-8-12(2)10(14-3)9-11(13)15-12/h9H,4-8H2,1-3H3