(3S)-3-azanyl-3-(2,4,5-trimethylphenyl)propanoic acid

Systemtic Name: (3S)-3-azanyl-3-(2,4,5-trimethylphenyl)propanoic acid Openeye Name: (3S)-3-amino-3-(2,4,5-trimethylphenyl)propanoic acid CAS Name: (3S)-3-amino-3-(2,4,5-trimethylphenyl)propanoic acid IUPAC Name: (3S)-3-amino-3-(2,4,5-trimethylphenyl)propanoic acid Traditional Name: (3S)-3-amino-3-(2,4,5-trimethylphenyl)propionic acid Formula: C12H17NO2 MolecularWeight: 207.26888

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C)C(CC(=O)O)N)C

Isomeric SMILES

CC1=CC(=C(C=C1C)[C@H](CC(=O)O)N)C

InChI

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