sodium 2-[1-(5-chloranyl-2-phenylmethoxy-phenyl)-5-methyl-pyrazol-3-yl]ethanoate

Systemtic Name: sodium 2-[1-(5-chloranyl-2-phenylmethoxy-phenyl)-5-methyl-pyrazol-3-yl]ethanoate Openeye Name: sodium 2-[1-(2-benzyloxy-5-chloro-phenyl)-5-methyl-pyrazol-3-yl]acetate CAS Name: sodium 2-[1-(5-chloro-2-phenylmethoxyphenyl)-5-methyl-3-pyrazolyl]acetate IUPAC Name: sodium 2-[1-(5-chloro-2-phenylmethoxyphenyl)-5-methylpyrazol-3-yl]acetate Traditional Name: sodium 2-[1-(2-benzoxy-5-chloro-phenyl)-5-methyl-pyrazol-3-yl]acetate Formula: C19H16ClN2NaO3 MolecularWeight: 378.78471

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=C(C=CC(=C2)Cl)OCC3=CC=CC=C3)CC(=O)[O-].[Na+]

Isomeric SMILES

CC1=CC(=NN1C2=C(C=CC(=C2)Cl)OCC3=CC=CC=C3)CC(=O)[O-].[Na+]

InChI

InChI=1S/C19H17ClN2O3.Na/c1-13-9-16(11-19(23)24)21-22(13)17-10-15(20)7-8-18(17)25-12-14-5-3-2-4-6-14;/h2-10H,11-12H2,1H3,(H,23,24);/q;+1/p-1