[2-(4-methylsulfanylphenyl)-2-oxidanylidene-ethyl] 2,3,4-trimethoxybenzoate

Systemtic Name: [2-(4-methylsulfanylphenyl)-2-oxidanylidene-ethyl] 2,3,4-trimethoxybenzoate Openeye Name: [2-(4-methylsulfanylphenyl)-2-oxo-ethyl] 2,3,4-trimethoxybenzoate CAS Name: 2,3,4-trimethoxybenzoic acid [2-[4-(methylthio)phenyl]-2-oxoethyl] ester IUPAC Name: [2-(4-methylsulfanylphenyl)-2-oxoethyl] 2,3,4-trimethoxybenzoate Traditional Name: 2,3,4-trimethoxybenzoic acid [2-keto-2-[4-(methylthio)phenyl]ethyl] ester Formula: C19H20O6S MolecularWeight: 376.4235

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)C(=O)OCC(=O)C2=CC=C(C=C2)SC)OC)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)C(=O)OCC(=O)C2=CC=C(C=C2)SC)OC)OC

InChI

InChI=1S/C19H20O6S/c1-22-16-10-9-14(17(23-2)18(16)24-3)19(21)25-11-15(20)12-5-7-13(26-4)8-6-12/h5-10H,11H2,1-4H3