5-hexyl-5-methyl-4-prop-2-ynoxy-thiophen-2-one

Systemtic Name: 5-hexyl-5-methyl-4-prop-2-ynoxy-thiophen-2-one Openeye Name: 5-hexyl-5-methyl-4-prop-2-ynoxy-thiophen-2-one CAS Name: 5-hexyl-5-methyl-4-prop-2-ynoxy-2-thiophenone IUPAC Name: 5-hexyl-5-methyl-4-prop-2-ynoxythiophen-2-one Traditional Name: 5-hexyl-5-methyl-4-propargyloxy-thiophen-2-one Formula: C14H20O2S MolecularWeight: 252.3724

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1(C(=CC(=O)S1)OCC#C)C

Isomeric SMILES

CCCCCCC1(C(=CC(=O)S1)OCC#C)C

InChI

InChI=1S/C14H20O2S/c1-4-6-7-8-9-14(3)12(16-10-5-2)11-13(15)17-14/h2,11H,4,6-10H2,1,3H3