sodium 5-(2-hydroxyphenyl)carbonyl-2-methoxy-4-oxidanyl-benzenesulfonate

Systemtic Name: sodium 5-(2-hydroxyphenyl)carbonyl-2-methoxy-4-oxidanyl-benzenesulfonate Openeye Name: sodium 4-hydroxy-5-(2-hydroxybenzoyl)-2-methoxy-benzenesulfonate CAS Name: sodium 4-hydroxy-5-[(2-hydroxyphenyl)-oxomethyl]-2-methoxybenzenesulfonate IUPAC Name: sodium 4-hydroxy-5-(2-hydroxybenzoyl)-2-methoxybenzenesulfonate Traditional Name: sodium 4-hydroxy-2-methoxy-5-salicyloyl-besylate Formula: C14H11NaO7S MolecularWeight: 346.28771

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)O)C(=O)C2=CC=CC=C2O)S(=O)(=O)[O-].[Na+]

Isomeric SMILES

COC1=C(C=C(C(=C1)O)C(=O)C2=CC=CC=C2O)S(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C14H12O7S.Na/c1-21-12-7-11(16)9(6-13(12)22(18,19)20)14(17)8-4-2-3-5-10(8)15;/h2-7,15-16H,1H3,(H,18,19,20);/q;+1/p-1