4-methyl-5-(2-methylpropyl)-2-oxidanyl-benzenecarbothioic S-acid

Systemtic Name: 4-methyl-5-(2-methylpropyl)-2-oxidanyl-benzenecarbothioic S-acid Openeye Name: 2-hydroxy-5-isobutyl-4-methyl-benzenecarbothioic S-acid CAS Name: 2-hydroxy-4-methyl-5-(2-methylpropyl)benzenecarbothioic S-acid IUPAC Name: 2-hydroxy-4-methyl-5-(2-methylpropyl)benzenecarbothioic S-acid Traditional Name: 2-hydroxy-5-isobutyl-4-methyl-thiobenzoic acid Formula: C12H16O2S MolecularWeight: 224.31924

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H16O2S/c1-7(2)4-9-6-10(12(14)15)11(13)5-8(9)3/h5-7,13H,4H2,1-3H3,(H,14,15)