S-(2-methyl-4-oxidanylidene-3-pentyl-cyclopent-2-en-1-yl) ethanethioate

Systemtic Name: S-(2-methyl-4-oxidanylidene-3-pentyl-cyclopent-2-en-1-yl) ethanethioate Openeye Name: S-(2-methyl-4-oxo-3-pentyl-cyclopent-2-en-1-yl) ethanethioate CAS Name: ethanethioic acid S-(2-methyl-4-oxo-3-pentyl-1-cyclopent-2-enyl) ester IUPAC Name: S-(2-methyl-4-oxo-3-pentylcyclopent-2-en-1-yl) ethanethioate Traditional Name: ethanethioic acid S-(3-amyl-4-keto-2-methyl-cyclopent-2-en-1-yl) ester Formula: C13H20O2S MolecularWeight: 240.3617

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=C(C(CC1=O)SC(=O)C)C

Isomeric SMILES

CCCCCC1=C(C(CC1=O)SC(=O)C)C

InChI

InChI=1S/C13H20O2S/c1-4-5-6-7-11-9(2)13(8-12(11)15)16-10(3)14/h13H,4-8H2,1-3H3