4-(4-chloranylbutoxy)-5-hexyl-5-methyl-thiophen-2-one

Systemtic Name: 4-(4-chloranylbutoxy)-5-hexyl-5-methyl-thiophen-2-one Openeye Name: 4-(4-chlorobutoxy)-5-hexyl-5-methyl-thiophen-2-one CAS Name: 4-(4-chlorobutoxy)-5-hexyl-5-methyl-2-thiophenone IUPAC Name: 4-(4-chlorobutoxy)-5-hexyl-5-methylthiophen-2-one Traditional Name: 4-(4-chlorobutoxy)-5-hexyl-5-methyl-thiophen-2-one Formula: C15H25ClO2S MolecularWeight: 304.8758

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H25ClO2S/c1-3-4-5-6-9-15(2)13(12-14(17)19-15)18-11-8-7-10-16/h12H,3-11H2,1-2H3