4-methyl-3-propan-2-ylsulfanyl-benzoic acid

Systemtic Name: 4-methyl-3-propan-2-ylsulfanyl-benzoic acid Openeye Name: 3-isopropylsulfanyl-4-methyl-benzoic acid CAS Name: 4-methyl-3-(propan-2-ylthio)benzoic acid IUPAC Name: 4-methyl-3-propan-2-ylsulfanylbenzoic acid Traditional Name: 3-(isopropylthio)-4-methyl-benzoic acid Formula: C11H14O2S MolecularWeight: 210.29266

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)O)SC(C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)O)SC(C)C

InChI

InChI=1S/C11H14O2S/c1-7(2)14-10-6-9(11(12)13)5-4-8(10)3/h4-7H,1-3H3,(H,12,13)