(4-methylsulfanylphenyl) 3-(3,4,5-trimethoxyphenyl)propanoate

Systemtic Name: (4-methylsulfanylphenyl) 3-(3,4,5-trimethoxyphenyl)propanoate Openeye Name: (4-methylsulfanylphenyl) 3-(3,4,5-trimethoxyphenyl)propanoate CAS Name: 3-(3,4,5-trimethoxyphenyl)propanoic acid [4-(methylthio)phenyl] ester IUPAC Name: (4-methylsulfanylphenyl) 3-(3,4,5-trimethoxyphenyl)propanoate Traditional Name: 3-(3,4,5-trimethoxyphenyl)propionic acid [4-(methylthio)phenyl] ester Formula: C19H22O5S MolecularWeight: 362.43998

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H22O5S/c1-21-16-11-13(12-17(22-2)19(16)23-3)5-10-18(20)24-14-6-8-15(25-4)9-7-14/h6-9,11-12H,5,10H2,1-4H3