methyl (2S)-2-[(3-methoxy-2-oxidanyl-phenyl)methylamino]propanoate

Systemtic Name: methyl (2S)-2-[(3-methoxy-2-oxidanyl-phenyl)methylamino]propanoate Openeye Name: methyl (2S)-2-[(2-hydroxy-3-methoxy-phenyl)methylamino]propanoate CAS Name: (2S)-2-[(2-hydroxy-3-methoxyphenyl)methylamino]propanoic acid methyl ester IUPAC Name: methyl (2S)-2-[(2-hydroxy-3-methoxyphenyl)methylamino]propanoate Traditional Name: (2S)-2-[(2-hydroxy-3-methoxy-benzyl)amino]propionic acid methyl ester Formula: C12H17NO4 MolecularWeight: 239.26768

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H17NO4/c1-8(12(15)17-3)13-7-9-5-4-6-10(16-2)11(9)14/h4-6,8,13-14H,7H2,1-3H3/t8-/m0/s1