sodium 5-oxidanyl-2-[2-(3-phenylphenyl)ethanoyloxy]benzoate

Systemtic Name: sodium 5-oxidanyl-2-[2-(3-phenylphenyl)ethanoyloxy]benzoate Openeye Name: sodium 5-hydroxy-2-[2-(3-phenylphenyl)acetyl]oxy-benzoate CAS Name: sodium 5-hydroxy-2-[1-oxo-2-(3-phenylphenyl)ethoxy]benzoate IUPAC Name: sodium 5-hydroxy-2-[2-(3-phenylphenyl)acetyl]oxybenzoate Traditional Name: sodium 5-hydroxy-2-[2-(3-phenylphenyl)acetyl]oxy-benzoate Formula: C21H15NaO5 MolecularWeight: 370.33057

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H16O5.Na/c22-17-9-10-19(18(13-17)21(24)25)26-20(23)12-14-5-4-8-16(11-14)15-6-2-1-3-7-15;/h1-11,13,22H,12H2,(H,24,25);/q;+1/p-1