(3S)-3-(2,4-dimethylphenyl)-3-(methylamino)propanoic acid

Systemtic Name: (3S)-3-(2,4-dimethylphenyl)-3-(methylamino)propanoic acid Openeye Name: (3S)-3-(2,4-dimethylphenyl)-3-(methylamino)propanoic acid CAS Name: (3S)-3-(2,4-dimethylphenyl)-3-(methylamino)propanoic acid IUPAC Name: (3S)-3-(2,4-dimethylphenyl)-3-(methylamino)propanoic acid Traditional Name: (3S)-3-(2,4-dimethylphenyl)-3-(methylamino)propionic acid Formula: C12H17NO2 MolecularWeight: 207.26888

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(CC(=O)O)NC)C

Isomeric SMILES

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

InChI

InChI=1S/C12H17NO2/c1-8-4-5-10(9(2)6-8)11(13-3)7-12(14)15/h4-6,11,13H,7H2,1-3H3,(H,14,15)/t11-/m0/s1