3-(1-methoxypropan-2-yloxy)-4-methylsulfanyl-benzoic acid

Systemtic Name: 3-(1-methoxypropan-2-yloxy)-4-methylsulfanyl-benzoic acid Openeye Name: 3-(2-methoxy-1-methyl-ethoxy)-4-methylsulfanyl-benzoic acid CAS Name: 3-(1-methoxypropan-2-yloxy)-4-(methylthio)benzoic acid IUPAC Name: 3-(1-methoxypropan-2-yloxy)-4-methylsulfanylbenzoic acid Traditional Name: 3-(2-methoxy-1-methyl-ethoxy)-4-(methylthio)benzoic acid Formula: C12H16O4S MolecularWeight: 256.31804

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC)OC1=C(C=CC(=C1)C(=O)O)SC

Isomeric SMILES

CC(COC)OC1=C(C=CC(=C1)C(=O)O)SC

InChI

InChI=1S/C12H16O4S/c1-8(7-15-2)16-10-6-9(12(13)14)4-5-11(10)17-3/h4-6,8H,7H2,1-3H3,(H,13,14)