sodium 2-chloranyl-6-(4,6-dimethoxypyrimidin-2-yl)carbonyl-benzoate

Systemtic Name: sodium 2-chloranyl-6-(4,6-dimethoxypyrimidin-2-yl)carbonyl-benzoate Openeye Name: sodium 2-chloro-6-(4,6-dimethoxypyrimidine-2-carbonyl)benzoate CAS Name: sodium 2-chloro-6-[(4,6-dimethoxy-2-pyrimidinyl)-oxomethyl]benzoate IUPAC Name: sodium 2-chloro-6-(4,6-dimethoxypyrimidine-2-carbonyl)benzoate Traditional Name: sodium 2-chloro-6-(4,6-dimethoxypyrimidine-2-carbonyl)benzoate Formula: C14H10ClN2NaO5 MolecularWeight: 344.68237

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=NC(=N1)C(=O)C2=C(C(=CC=C2)Cl)C(=O)[O-])OC.[Na+]

Isomeric SMILES

COC1=CC(=NC(=N1)C(=O)C2=C(C(=CC=C2)Cl)C(=O)[O-])OC.[Na+]

InChI

InChI=1S/C14H11ClN2O5.Na/c1-21-9-6-10(22-2)17-13(16-9)12(18)7-4-3-5-8(15)11(7)14(19)20;/h3-6H,1-2H3,(H,19,20);/q;+1/p-1