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

Systemtic Name: 3-phenyl-2-[[4-(2-phenylmethoxypyrimidin-5-yl)phenyl]carbonylamino]propanoic acid Openeye Name: 2-[[4-(2-benzyloxypyrimidin-5-yl)benzoyl]amino]-3-phenyl-propanoic acid CAS Name: 2-[[oxo-[4-(2-phenylmethoxy-5-pyrimidinyl)phenyl]methyl]amino]-3-phenylpropanoic acid IUPAC Name: 3-phenyl-2-[[4-(2-phenylmethoxypyrimidin-5-yl)benzoyl]amino]propanoic acid Traditional Name: 2-[[4-(2-benzoxypyrimidin-5-yl)benzoyl]amino]-3-phenyl-propionic acid Formula: C27H23N3O4 MolecularWeight: 453.48922

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)O)NC(=O)C2=CC=C(C=C2)C3=CN=C(N=C3)OCC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CC(C(=O)O)NC(=O)C2=CC=C(C=C2)C3=CN=C(N=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C27H23N3O4/c31-25(30-24(26(32)33)15-19-7-3-1-4-8-19)22-13-11-21(12-14-22)23-16-28-27(29-17-23)34-18-20-9-5-2-6-10-20/h1-14,16-17,24H,15,18H2,(H,30,31)(H,32,33)