2-azanyl-3-[4-(2,2-dimethylpropanoyloxy)-2-fluoranyl-5-oxidanyl-phenyl]propanoic acid

Systemtic Name: 2-azanyl-3-[4-(2,2-dimethylpropanoyloxy)-2-fluoranyl-5-oxidanyl-phenyl]propanoic acid Openeye Name: 2-amino-3-[4-(2,2-dimethylpropanoyloxy)-2-fluoranyl-5-hydroxy-phenyl]propanoic acid CAS Name: 2-amino-3-[4-(2,2-dimethyl-1-oxopropoxy)-2-fluoranyl-5-hydroxyphenyl]propanoic acid IUPAC Name: 2-amino-3-[4-(2,2-dimethylpropanoyloxy)-2-fluoranyl-5-hydroxyphenyl]propanoic acid Traditional Name: 2-amino-3-(2-fluoranyl-5-hydroxy-4-pivaloyloxy-phenyl)propionic acid Formula: C14H18FNO5 MolecularWeight: 298.297358

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)OC1=C(C=C(C(=C1)F)CC(C(=O)O)N)O

Isomeric SMILES

CC(C)(C)C(=O)OC1=C(C=C(C(=C1)[18F])CC(C(=O)O)N)O

InChI

InChI=1S/C14H18FNO5/c1-14(2,3)13(20)21-11-6-8(15)7(5-10(11)17)4-9(16)12(18)19/h5-6,9,17H,4,16H2,1-3H3,(H,18,19)/i15-1