methyl 3-[2-oxidanylidene-2-[(3,4,5-trimethoxyphenyl)methylamino]ethyl]sulfanylpropanoate

Systemtic Name: methyl 3-[2-oxidanylidene-2-[(3,4,5-trimethoxyphenyl)methylamino]ethyl]sulfanylpropanoate Openeye Name: methyl 3-[2-oxo-2-[(3,4,5-trimethoxyphenyl)methylamino]ethyl]sulfanylpropanoate CAS Name: 3-[[2-oxo-2-[(3,4,5-trimethoxyphenyl)methylamino]ethyl]thio]propanoic acid methyl ester IUPAC Name: methyl 3-[2-oxo-2-[(3,4,5-trimethoxyphenyl)methylamino]ethyl]sulfanylpropanoate Traditional Name: 3-[[2-keto-2-[(3,4,5-trimethoxybenzyl)amino]ethyl]thio]propionic acid methyl ester Formula: C16H23NO6S MolecularWeight: 357.42192

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)CNC(=O)CSCCC(=O)OC

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)CNC(=O)CSCCC(=O)OC

InChI

InChI=1S/C16H23NO6S/c1-20-12-7-11(8-13(21-2)16(12)23-4)9-17-14(18)10-24-6-5-15(19)22-3/h7-8H,5-6,9-10H2,1-4H3,(H,17,18)