(E)-3-(3,5-dimethyl-4-oxidanyl-phenyl)sulfanyl-4-oxidanyl-pent-3-en-2-one

Systemtic Name: (E)-3-(3,5-dimethyl-4-oxidanyl-phenyl)sulfanyl-4-oxidanyl-pent-3-en-2-one Openeye Name: (E)-4-hydroxy-3-(4-hydroxy-3,5-dimethyl-phenyl)sulfanyl-pent-3-en-2-one CAS Name: (E)-4-hydroxy-3-[(4-hydroxy-3,5-dimethylphenyl)thio]-3-penten-2-one IUPAC Name: (E)-4-hydroxy-3-(4-hydroxy-3,5-dimethylphenyl)sulfanylpent-3-en-2-one Traditional Name: (E)-4-hydroxy-3-[(4-hydroxy-3,5-dimethyl-phenyl)thio]pent-3-en-2-one Formula: C13H16O3S MolecularWeight: 252.32934

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1O)C)SC(=C(C)O)C(=O)C

Isomeric SMILES

CC1=CC(=CC(=C1O)C)S/C(=C(\C)/O)/C(=O)C

InChI

InChI=1S/C13H16O3S/c1-7-5-11(6-8(2)12(7)16)17-13(9(3)14)10(4)15/h5-6,14,16H,1-4H3/b13-9+