sodium 4-[4-(4-fluoranylphenoxy)phenyl]pyrimidine-2-carboxylate

Systemtic Name: sodium 4-[4-(4-fluoranylphenoxy)phenyl]pyrimidine-2-carboxylate Openeye Name: sodium 4-[4-(4-fluorophenoxy)phenyl]pyrimidine-2-carboxylate CAS Name: sodium 4-[4-(4-fluorophenoxy)phenyl]-2-pyrimidinecarboxylate IUPAC Name: sodium 4-[4-(4-fluorophenoxy)phenyl]pyrimidine-2-carboxylate Traditional Name: sodium 4-[4-(4-fluorophenoxy)phenyl]pyrimidine-2-carboxylate Formula: C17H10FN2NaO3 MolecularWeight: 332.261073

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NC(=NC=C2)C(=O)[O-])OC3=CC=C(C=C3)F.[Na+]

Isomeric SMILES

C1=CC(=CC=C1C2=NC(=NC=C2)C(=O)[O-])OC3=CC=C(C=C3)F.[Na+]

InChI

InChI=1S/C17H11FN2O3.Na/c18-12-3-7-14(8-4-12)23-13-5-1-11(2-6-13)15-9-10-19-16(20-15)17(21)22;/h1-10H,(H,21,22);/q;+1/p-1