(2R)-2-(azaniumylmethyl)-3-(2,4,6-trimethylphenyl)propanoate

Systemtic Name: (2R)-2-(azaniumylmethyl)-3-(2,4,6-trimethylphenyl)propanoate Openeye Name: (2R)-2-(azaniumylmethyl)-3-(2,4,6-trimethylphenyl)propanoate CAS Name: (2R)-2-(ammoniomethyl)-3-(2,4,6-trimethylphenyl)propanoate IUPAC Name: (2R)-2-(azaniumylmethyl)-3-(2,4,6-trimethylphenyl)propanoate Traditional Name: (2R)-2-(ammoniomethyl)-3-mesityl-propionate Formula: C13H19NO2 MolecularWeight: 221.29546

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)CC(C[NH3+])C(=O)[O-])C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)C[C@H](C[NH3+])C(=O)[O-])C

InChI

InChI=1S/C13H19NO2/c1-8-4-9(2)12(10(3)5-8)6-11(7-14)13(15)16/h4-5,11H,6-7,14H2,1-3H3,(H,15,16)/t11-/m1/s1