(4-methylsulfanylphenyl) 2-(3,4,5-trimethoxyphenyl)ethanoate

Systemtic Name: (4-methylsulfanylphenyl) 2-(3,4,5-trimethoxyphenyl)ethanoate Openeye Name: (4-methylsulfanylphenyl) 2-(3,4,5-trimethoxyphenyl)acetate CAS Name: 2-(3,4,5-trimethoxyphenyl)acetic acid [4-(methylthio)phenyl] ester IUPAC Name: (4-methylsulfanylphenyl) 2-(3,4,5-trimethoxyphenyl)acetate Traditional Name: 2-(3,4,5-trimethoxyphenyl)acetic acid [4-(methylthio)phenyl] ester Formula: C18H20O5S MolecularWeight: 348.4134

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)CC(=O)OC2=CC=C(C=C2)SC

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)CC(=O)OC2=CC=C(C=C2)SC

InChI

InChI=1S/C18H20O5S/c1-20-15-9-12(10-16(21-2)18(15)22-3)11-17(19)23-13-5-7-14(24-4)8-6-13/h5-10H,11H2,1-4H3