sodium 6-[(5-chloranyl-2-phenylmethoxy-phenyl)methyl]pyridine-2-carboxylate

Systemtic Name: sodium 6-[(5-chloranyl-2-phenylmethoxy-phenyl)methyl]pyridine-2-carboxylate Openeye Name: sodium 6-[(2-benzyloxy-5-chloro-phenyl)methyl]pyridine-2-carboxylate CAS Name: sodium 6-[(5-chloro-2-phenylmethoxyphenyl)methyl]-2-pyridinecarboxylate IUPAC Name: sodium 6-[(5-chloro-2-phenylmethoxyphenyl)methyl]pyridine-2-carboxylate Traditional Name: sodium 6-(2-benzoxy-5-chloro-benzyl)picolinate Formula: C20H15ClNNaO3 MolecularWeight: 375.78077

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=C(C=C(C=C2)Cl)CC3=CC=CC(=N3)C(=O)[O-].[Na+]

Isomeric SMILES

C1=CC=C(C=C1)COC2=C(C=C(C=C2)Cl)CC3=CC=CC(=N3)C(=O)[O-].[Na+]

InChI

InChI=1S/C20H16ClNO3.Na/c21-16-9-10-19(25-13-14-5-2-1-3-6-14)15(11-16)12-17-7-4-8-18(22-17)20(23)24;/h1-11H,12-13H2,(H,23,24);/q;+1/p-1