S-(3-ethanoyl-1-phenyl-hexyl) ethanethioate

Systemtic Name: S-(3-ethanoyl-1-phenyl-hexyl) ethanethioate Openeye Name: S-(3-acetyl-1-phenyl-hexyl) ethanethioate CAS Name: ethanethioic acid S-(3-acetyl-1-phenylhexyl) ester IUPAC Name: S-(3-acetyl-1-phenylhexyl) ethanethioate Traditional Name: ethanethioic acid S-(3-acetyl-1-phenyl-hexyl) ester Formula: C16H22O2S MolecularWeight: 278.40968

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CC(C1=CC=CC=C1)SC(=O)C)C(=O)C

Isomeric SMILES

CCCC(CC(C1=CC=CC=C1)SC(=O)C)C(=O)C

InChI

InChI=1S/C16H22O2S/c1-4-8-15(12(2)17)11-16(19-13(3)18)14-9-6-5-7-10-14/h5-7,9-10,15-16H,4,8,11H2,1-3H3