sodium 2-[4-(4-phenyl-6-phenylmethoxy-pyrimidin-2-yl)phenoxy]ethanoate

Systemtic Name: sodium 2-[4-(4-phenyl-6-phenylmethoxy-pyrimidin-2-yl)phenoxy]ethanoate Openeye Name: sodium 2-[4-(4-benzyloxy-6-phenyl-pyrimidin-2-yl)phenoxy]acetate CAS Name: sodium 2-[4-(4-phenyl-6-phenylmethoxy-2-pyrimidinyl)phenoxy]acetate IUPAC Name: sodium 2-[4-(4-phenyl-6-phenylmethoxypyrimidin-2-yl)phenoxy]acetate Traditional Name: sodium 2-[4-(4-benzoxy-6-phenyl-pyrimidin-2-yl)phenoxy]acetate Formula: C25H19N2NaO4 MolecularWeight: 434.41913

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=NC(=NC(=C2)C3=CC=CC=C3)C4=CC=C(C=C4)OCC(=O)[O-].[Na+]

Isomeric SMILES

C1=CC=C(C=C1)COC2=NC(=NC(=C2)C3=CC=CC=C3)C4=CC=C(C=C4)OCC(=O)[O-].[Na+]

InChI

InChI=1S/C25H20N2O4.Na/c28-24(29)17-30-21-13-11-20(12-14-21)25-26-22(19-9-5-2-6-10-19)15-23(27-25)31-16-18-7-3-1-4-8-18;/h1-15H,16-17H2,(H,28,29);/q;+1/p-1