methyl (2R)-2-[(2,4-dimethoxyphenyl)methylamino]-3-prop-2-enylsulfanyl-propanoate

Systemtic Name: methyl (2R)-2-[(2,4-dimethoxyphenyl)methylamino]-3-prop-2-enylsulfanyl-propanoate Openeye Name: methyl (2R)-3-allylsulfanyl-2-[(2,4-dimethoxyphenyl)methylamino]propanoate CAS Name: (2R)-2-[(2,4-dimethoxyphenyl)methylamino]-3-(prop-2-enylthio)propanoic acid methyl ester IUPAC Name: methyl (2R)-2-[(2,4-dimethoxyphenyl)methylamino]-3-prop-2-enylsulfanylpropanoate Traditional Name: (2R)-3-(allylthio)-2-[(2,4-dimethoxybenzyl)amino]propionic acid methyl ester Formula: C16H23NO4S MolecularWeight: 325.42312

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)CNC(CSCC=C)C(=O)OC)OC

Isomeric SMILES

COC1=CC(=C(C=C1)CN[C@@H](CSCC=C)C(=O)OC)OC

InChI

InChI=1S/C16H23NO4S/c1-5-8-22-11-14(16(18)21-4)17-10-12-6-7-13(19-2)9-15(12)20-3/h5-7,9,14,17H,1,8,10-11H2,2-4H3/t14-/m0/s1