3-(3-tert-butyl-5-methyl-4-oxidanyl-phenyl)-2-sulfanyl-propanoyl chloride

Systemtic Name: 3-(3-tert-butyl-5-methyl-4-oxidanyl-phenyl)-2-sulfanyl-propanoyl chloride Openeye Name: 3-(3-tert-butyl-4-hydroxy-5-methyl-phenyl)-2-sulfanyl-propanoyl chloride CAS Name: 3-(3-tert-butyl-4-hydroxy-5-methylphenyl)-2-mercaptopropanoyl chloride IUPAC Name: 3-(3-tert-butyl-4-hydroxy-5-methylphenyl)-2-sulfanylpropanoyl chloride Traditional Name: 3-(3-tert-butyl-4-hydroxy-5-methyl-phenyl)-2-mercapto-propionyl chloride Formula: C14H19ClO2S MolecularWeight: 286.81746

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)CC(C(=O)Cl)S)C(C)(C)C)O

Isomeric SMILES

CC1=C(C(=CC(=C1)CC(C(=O)Cl)S)C(C)(C)C)O

InChI

InChI=1S/C14H19ClO2S/c1-8-5-9(7-11(18)13(15)17)6-10(12(8)16)14(2,3)4/h5-6,11,16,18H,7H2,1-4H3