3-phenyl-2-[(5-phenylmethoxypyrimidin-4-yl)amino]propanoic acid

Systemtic Name: 3-phenyl-2-[(5-phenylmethoxypyrimidin-4-yl)amino]propanoic acid Openeye Name: 2-[(5-benzyloxypyrimidin-4-yl)amino]-3-phenyl-propanoic acid CAS Name: 3-phenyl-2-[(5-phenylmethoxy-4-pyrimidinyl)amino]propanoic acid IUPAC Name: 3-phenyl-2-[(5-phenylmethoxypyrimidin-4-yl)amino]propanoic acid Traditional Name: 2-[(5-benzoxypyrimidin-4-yl)amino]-3-phenyl-propionic acid Formula: C20H19N3O3 MolecularWeight: 349.38316

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)O)NC2=NC=NC=C2OCC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CC(C(=O)O)NC2=NC=NC=C2OCC3=CC=CC=C3

InChI

InChI=1S/C20H19N3O3/c24-20(25)17(11-15-7-3-1-4-8-15)23-19-18(12-21-14-22-19)26-13-16-9-5-2-6-10-16/h1-10,12,14,17H,11,13H2,(H,24,25)(H,21,22,23)