methyl (2S)-2-[(3,5-dimethyl-4-oxidanyl-phenyl)methylamino]propanoate

Systemtic Name: methyl (2S)-2-[(3,5-dimethyl-4-oxidanyl-phenyl)methylamino]propanoate Openeye Name: methyl (2S)-2-[(4-hydroxy-3,5-dimethyl-phenyl)methylamino]propanoate CAS Name: (2S)-2-[(4-hydroxy-3,5-dimethylphenyl)methylamino]propanoic acid methyl ester IUPAC Name: methyl (2S)-2-[(4-hydroxy-3,5-dimethylphenyl)methylamino]propanoate Traditional Name: (2S)-2-[(4-hydroxy-3,5-dimethyl-benzyl)amino]propionic acid methyl ester Formula: C13H19NO3 MolecularWeight: 237.29486

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1O)C)CNC(C)C(=O)OC

Isomeric SMILES

CC1=CC(=CC(=C1O)C)CN[C@@H](C)C(=O)OC

InChI

InChI=1S/C13H19NO3/c1-8-5-11(6-9(2)12(8)15)7-14-10(3)13(16)17-4/h5-6,10,14-15H,7H2,1-4H3/t10-/m0/s1