1-(2-oxidanyl-3-propyl-4-sulfanyl-phenyl)ethanone

Systemtic Name: 1-(2-oxidanyl-3-propyl-4-sulfanyl-phenyl)ethanone Openeye Name: 1-(2-hydroxy-3-propyl-4-sulfanyl-phenyl)ethanone CAS Name: 1-(2-hydroxy-4-mercapto-3-propylphenyl)ethanone IUPAC Name: 1-(2-hydroxy-3-propyl-4-sulfanylphenyl)ethanone Traditional Name: 1-(2-hydroxy-4-mercapto-3-propyl-phenyl)ethanone Formula: C11H14O2S MolecularWeight: 210.29266

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1O)C(=O)C)S

Isomeric SMILES

CCCC1=C(C=CC(=C1O)C(=O)C)S

InChI

InChI=1S/C11H14O2S/c1-3-4-9-10(14)6-5-8(7(2)12)11(9)13/h5-6,13-14H,3-4H2,1-2H3