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2-phenyl-3-(pyrimidin-4-ylamino)propanoic acid

2-phenyl-3-(pyrimidin-4-ylamino)propanoic acid

Systemtic Name:2-phenyl-3-(pyrimidin-4-ylamino)propanoic acid
Openeye Name:2-phenyl-3-(pyrimidin-4-ylamino)propanoic acid
CAS Name:2-phenyl-3-(4-pyrimidinylamino)propanoic acid
IUPAC Name:2-phenyl-3-(pyrimidin-4-ylamino)propanoic acid
Traditional Name:2-phenyl-3-(4-pyrimidylamino)propionic acid
Formula: C13H13N3O2
MolecularWeight: 243.26122
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CNC2=NC=NC=C2)C(=O)O


Isomeric SMILES

C1=CC=C(C=C1)C(CNC2=NC=NC=C2)C(=O)O


InChI

InChI=1S/C13H13N3O2/c17-13(18)11(10-4-2-1-3-5-10)8-15-12-6-7-14-9-16-12/h1-7,9,11H,8H2,(H,17,18)(H,14,15,16)


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