5-tert-butyl-2-methyl-3-(2-methylpropylsulfanyl)-6-oxidanyl-benzoic acid

Systemtic Name: 5-tert-butyl-2-methyl-3-(2-methylpropylsulfanyl)-6-oxidanyl-benzoic acid Openeye Name: 3-tert-butyl-2-hydroxy-5-isobutylsulfanyl-6-methyl-benzoic acid CAS Name: 3-tert-butyl-2-hydroxy-6-methyl-5-(2-methylpropylthio)benzoic acid IUPAC Name: 3-tert-butyl-2-hydroxy-6-methyl-5-(2-methylpropylsulfanyl)benzoic acid Traditional Name: 3-tert-butyl-2-hydroxy-5-(isobutylthio)-6-methyl-benzoic acid Formula: C16H24O3S MolecularWeight: 296.42496

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C(=C1C(=O)O)O)C(C)(C)C)SCC(C)C

Isomeric SMILES

CC1=C(C=C(C(=C1C(=O)O)O)C(C)(C)C)SCC(C)C

InChI

InChI=1S/C16H24O3S/c1-9(2)8-20-12-7-11(16(4,5)6)14(17)13(10(12)3)15(18)19/h7,9,17H,8H2,1-6H3,(H,18,19)