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

Systemtic Name: (4-methylsulfanylphenyl)methyl 2-(3,4,5-trimethoxyphenyl)ethanoate Openeye Name: (4-methylsulfanylphenyl)methyl 2-(3,4,5-trimethoxyphenyl)acetate CAS Name: 2-(3,4,5-trimethoxyphenyl)acetic acid [4-(methylthio)phenyl]methyl ester IUPAC Name: (4-methylsulfanylphenyl)methyl 2-(3,4,5-trimethoxyphenyl)acetate Traditional Name: 2-(3,4,5-trimethoxyphenyl)acetic acid [4-(methylthio)benzyl] ester Formula: C19H22O5S MolecularWeight: 362.43998

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)CC(=O)OCC2=CC=C(C=C2)SC

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)CC(=O)OCC2=CC=C(C=C2)SC

InChI

InChI=1S/C19H22O5S/c1-21-16-9-14(10-17(22-2)19(16)23-3)11-18(20)24-12-13-5-7-15(25-4)8-6-13/h5-10H,11-12H2,1-4H3