(4-methylsulfanylphenyl)methyl 2,4,5-trimethoxybenzoate

Systemtic Name: (4-methylsulfanylphenyl)methyl 2,4,5-trimethoxybenzoate Openeye Name: (4-methylsulfanylphenyl)methyl 2,4,5-trimethoxybenzoate CAS Name: 2,4,5-trimethoxybenzoic acid [4-(methylthio)phenyl]methyl ester IUPAC Name: (4-methylsulfanylphenyl)methyl 2,4,5-trimethoxybenzoate Traditional Name: 2,4,5-trimethoxybenzoic acid [4-(methylthio)benzyl] ester Formula: C18H20O5S MolecularWeight: 348.4134

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C(=O)OCC2=CC=C(C=C2)SC)OC)OC

Isomeric SMILES

COC1=CC(=C(C=C1C(=O)OCC2=CC=C(C=C2)SC)OC)OC

InChI

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