methyl (2S)-2-[(3-bromanyl-4,5-dimethoxy-phenyl)methylamino]propanoate

Systemtic Name: methyl (2S)-2-[(3-bromanyl-4,5-dimethoxy-phenyl)methylamino]propanoate Openeye Name: methyl (2S)-2-[(3-bromo-4,5-dimethoxy-phenyl)methylamino]propanoate CAS Name: (2S)-2-[(3-bromo-4,5-dimethoxyphenyl)methylamino]propanoic acid methyl ester IUPAC Name: methyl (2S)-2-[(3-bromo-4,5-dimethoxyphenyl)methylamino]propanoate Traditional Name: (2S)-2-[(3-bromo-4,5-dimethoxy-benzyl)amino]propionic acid methyl ester Formula: C13H18BrNO4 MolecularWeight: 332.19032

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC)NCC1=CC(=C(C(=C1)Br)OC)OC

Isomeric SMILES

C[C@@H](C(=O)OC)NCC1=CC(=C(C(=C1)Br)OC)OC

InChI

InChI=1S/C13H18BrNO4/c1-8(13(16)19-4)15-7-9-5-10(14)12(18-3)11(6-9)17-2/h5-6,8,15H,7H2,1-4H3/t8-/m0/s1