2-(3-tert-butyl-4-oxidanyl-phenyl)-4,4-dimethyl-2-sulfanyl-pentanoic acid

Systemtic Name: 2-(3-tert-butyl-4-oxidanyl-phenyl)-4,4-dimethyl-2-sulfanyl-pentanoic acid Openeye Name: 2-(3-tert-butyl-4-hydroxy-phenyl)-4,4-dimethyl-2-sulfanyl-pentanoic acid CAS Name: 2-(3-tert-butyl-4-hydroxyphenyl)-2-mercapto-4,4-dimethylpentanoic acid IUPAC Name: 2-(3-tert-butyl-4-hydroxyphenyl)-4,4-dimethyl-2-sulfanylpentanoic acid Traditional Name: 2-(3-tert-butyl-4-hydroxy-phenyl)-2-mercapto-4,4-dimethyl-valeric acid Formula: C17H26O3S MolecularWeight: 310.45154

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H26O3S/c1-15(2,3)10-17(21,14(19)20)11-7-8-13(18)12(9-11)16(4,5)6/h7-9,18,21H,10H2,1-6H3,(H,19,20)