(3S)-3-azanyl-3-[2-(4-fluorophenyl)pyrimidin-5-yl]propanoic acid

Systemtic Name: (3S)-3-azanyl-3-[2-(4-fluorophenyl)pyrimidin-5-yl]propanoic acid Openeye Name: (3S)-3-amino-3-[2-(4-fluorophenyl)pyrimidin-5-yl]propanoic acid CAS Name: (3S)-3-amino-3-[2-(4-fluorophenyl)-5-pyrimidinyl]propanoic acid IUPAC Name: (3S)-3-amino-3-[2-(4-fluorophenyl)pyrimidin-5-yl]propanoic acid Traditional Name: (3S)-3-amino-3-[2-(4-fluorophenyl)pyrimidin-5-yl]propionic acid Formula: C13H12FN3O2 MolecularWeight: 261.251683

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NC=C(C=N2)C(CC(=O)O)N)F

Isomeric SMILES

C1=CC(=CC=C1C2=NC=C(C=N2)[C@H](CC(=O)O)N)F

InChI

InChI=1S/C13H12FN3O2/c14-10-3-1-8(2-4-10)13-16-6-9(7-17-13)11(15)5-12(18)19/h1-4,6-7,11H,5,15H2,(H,18,19)/t11-/m0/s1