(2S)-2-azanyl-3-(4-methoxy-3-methyl-5-oxidanyl-phenyl)propanoic acid

Systemtic Name: (2S)-2-azanyl-3-(4-methoxy-3-methyl-5-oxidanyl-phenyl)propanoic acid Openeye Name: (2S)-2-amino-3-(3-hydroxy-4-methoxy-5-methyl-phenyl)propanoic acid CAS Name: (2S)-2-amino-3-(3-hydroxy-4-methoxy-5-methylphenyl)propanoic acid IUPAC Name: (2S)-2-amino-3-(3-hydroxy-4-methoxy-5-methylphenyl)propanoic acid Traditional Name: (2S)-2-amino-3-(3-hydroxy-4-methoxy-5-methyl-phenyl)propionic acid Formula: C11H15NO4 MolecularWeight: 225.2411

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)CC(C(=O)O)N)O)OC

Isomeric SMILES

CC1=C(C(=CC(=C1)C[C@@H](C(=O)O)N)O)OC

InChI

InChI=1S/C11H15NO4/c1-6-3-7(4-8(12)11(14)15)5-9(13)10(6)16-2/h3,5,8,13H,4,12H2,1-2H3,(H,14,15)/t8-/m0/s1