3-(2-ethylsulfanylethoxy)benzoic acid

Systemtic Name: 3-(2-ethylsulfanylethoxy)benzoic acid Openeye Name: 3-(2-ethylsulfanylethoxy)benzoic acid CAS Name: 3-[2-(ethylthio)ethoxy]benzoic acid IUPAC Name: 3-(2-ethylsulfanylethoxy)benzoic acid Traditional Name: 3-[2-(ethylthio)ethoxy]benzoic acid Formula: C11H14O3S MolecularWeight: 226.29206

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCSCCOC1=CC=CC(=C1)C(=O)O

Isomeric SMILES

CCSCCOC1=CC=CC(=C1)C(=O)O

InChI

InChI=1S/C11H14O3S/c1-2-15-7-6-14-10-5-3-4-9(8-10)11(12)13/h3-5,8H,2,6-7H2,1H3,(H,12,13)