2-azanyl-3-(4-pyrimidin-5-ylphenyl)propanoic acid

Systemtic Name: 2-azanyl-3-(4-pyrimidin-5-ylphenyl)propanoic acid Openeye Name: 2-amino-3-(4-pyrimidin-5-ylphenyl)propanoic acid CAS Name: 2-amino-3-[4-(5-pyrimidinyl)phenyl]propanoic acid IUPAC Name: 2-amino-3-(4-pyrimidin-5-ylphenyl)propanoic acid Traditional Name: 2-amino-3-[4-(5-pyrimidyl)phenyl]propionic acid Formula: C13H13N3O2 MolecularWeight: 243.26122

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC(C(=O)O)N)C2=CN=CN=C2

Isomeric SMILES

C1=CC(=CC=C1CC(C(=O)O)N)C2=CN=CN=C2

InChI

InChI=1S/C13H13N3O2/c14-12(13(17)18)5-9-1-3-10(4-2-9)11-6-15-8-16-7-11/h1-4,6-8,12H,5,14H2,(H,17,18)