sodium 2-[2-[6-(3-chloranylpropoxy)naphthalen-2-yl]-6-phenyl-pyrimidin-4-yl]oxyethanoate

Systemtic Name: sodium 2-[2-[6-(3-chloranylpropoxy)naphthalen-2-yl]-6-phenyl-pyrimidin-4-yl]oxyethanoate Openeye Name: sodium 2-[2-[6-(3-chloropropoxy)-2-naphthyl]-6-phenyl-pyrimidin-4-yl]oxyacetate CAS Name: sodium 2-[[2-[6-(3-chloropropoxy)-2-naphthalenyl]-6-phenyl-4-pyrimidinyl]oxy]acetate IUPAC Name: sodium 2-[2-[6-(3-chloropropoxy)naphthalen-2-yl]-6-phenylpyrimidin-4-yl]oxyacetate Traditional Name: sodium 2-[2-[6-(3-chloropropoxy)-2-naphthyl]-6-phenyl-pyrimidin-4-yl]oxyacetate Formula: C25H20ClN2NaO4 MolecularWeight: 470.88007

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=NC(=N2)C3=CC4=C(C=C3)C=C(C=C4)OCCCCl)OCC(=O)[O-].[Na+]

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=NC(=N2)C3=CC4=C(C=C3)C=C(C=C4)OCCCCl)OCC(=O)[O-].[Na+]

InChI

InChI=1S/C25H21ClN2O4.Na/c26-11-4-12-31-21-10-9-18-13-20(8-7-19(18)14-21)25-27-22(17-5-2-1-3-6-17)15-23(28-25)32-16-24(29)30;/h1-3,5-10,13-15H,4,11-12,16H2,(H,29,30);/q;+1/p-1