3-azanyl-3-(2,3,4,5,6-pentadeuteriophenyl)propanoic acid

Systemtic Name: 3-azanyl-3-(2,3,4,5,6-pentadeuteriophenyl)propanoic acid Openeye Name: 3-amino-3-(2,3,4,5,6-pentadeuteriophenyl)propanoic acid CAS Name: 3-amino-3-(2,3,4,5,6-pentadeuteriophenyl)propanoic acid IUPAC Name: 3-amino-3-(2,3,4,5,6-pentadeuteriophenyl)propanoic acid Traditional Name: 3-amino-3-(2,3,4,5,6-pentadeuteriophenyl)propionic acid Formula: C9H11NO2 MolecularWeight: 170.219949

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

[2H]C1=C(C(=C(C(=C1[2H])[2H])C(CC(=O)O)N)[2H])[2H]

InChI

InChI=1S/C9H11NO2/c10-8(6-9(11)12)7-4-2-1-3-5-7/h1-5,8H,6,10H2,(H,11,12)/i1D,2D,3D,4D,5D