3-[2-(3-tert-butyl-5-methyl-4-oxidanyl-phenyl)ethylsulfanyl]propanoic acid

Systemtic Name: 3-[2-(3-tert-butyl-5-methyl-4-oxidanyl-phenyl)ethylsulfanyl]propanoic acid Openeye Name: 3-[2-(3-tert-butyl-4-hydroxy-5-methyl-phenyl)ethylsulfanyl]propanoic acid CAS Name: 3-[2-(3-tert-butyl-4-hydroxy-5-methylphenyl)ethylthio]propanoic acid IUPAC Name: 3-[2-(3-tert-butyl-4-hydroxy-5-methylphenyl)ethylsulfanyl]propanoic acid Traditional Name: 3-[2-(3-tert-butyl-4-hydroxy-5-methyl-phenyl)ethylthio]propionic acid Formula: C16H24O3S MolecularWeight: 296.42496

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)CCSCCC(=O)O)C(C)(C)C)O

Isomeric SMILES

CC1=C(C(=CC(=C1)CCSCCC(=O)O)C(C)(C)C)O

InChI

InChI=1S/C16H24O3S/c1-11-9-12(5-7-20-8-6-14(17)18)10-13(15(11)19)16(2,3)4/h9-10,19H,5-8H2,1-4H3,(H,17,18)