2-[4-methoxy-2-(methylsulfanylmethyl)phenyl]ethanoic acid

Systemtic Name: 2-[4-methoxy-2-(methylsulfanylmethyl)phenyl]ethanoic acid Openeye Name: 2-[4-methoxy-2-(methylsulfanylmethyl)phenyl]acetic acid CAS Name: 2-[4-methoxy-2-[(methylthio)methyl]phenyl]acetic acid IUPAC Name: 2-[4-methoxy-2-(methylsulfanylmethyl)phenyl]acetic acid Traditional Name: 2-[4-methoxy-2-[(methylthio)methyl]phenyl]acetic acid Formula: C11H14O3S MolecularWeight: 226.29206

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)CC(=O)O)CSC

Isomeric SMILES

COC1=CC(=C(C=C1)CC(=O)O)CSC

InChI

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