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

Systemtic Name: (4-methylsulfanylphenyl)methyl 2-[(3,4,5-trimethoxyphenyl)carbonylamino]ethanoate Openeye Name: (4-methylsulfanylphenyl)methyl 2-[(3,4,5-trimethoxybenzoyl)amino]acetate CAS Name: 2-[[oxo-(3,4,5-trimethoxyphenyl)methyl]amino]acetic acid [4-(methylthio)phenyl]methyl ester IUPAC Name: (4-methylsulfanylphenyl)methyl 2-[(3,4,5-trimethoxybenzoyl)amino]acetate Traditional Name: 2-[(3,4,5-trimethoxybenzoyl)amino]acetic acid [4-(methylthio)benzyl] ester Formula: C20H23NO6S MolecularWeight: 405.46472

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23NO6S/c1-24-16-9-14(10-17(25-2)19(16)26-3)20(23)21-11-18(22)27-12-13-5-7-15(28-4)8-6-13/h5-10H,11-12H2,1-4H3,(H,21,23)