sodium 3-methoxy-4-(phenylsulfonyloxy)benzenesulfonate

Systemtic Name: sodium 3-methoxy-4-(phenylsulfonyloxy)benzenesulfonate Openeye Name: sodium 4-(benzenesulfonyloxy)-3-methoxy-benzenesulfonate CAS Name: sodium 4-(benzenesulfonyloxy)-3-methoxybenzenesulfonate IUPAC Name: sodium 4-(benzenesulfonyloxy)-3-methoxybenzenesulfonate Traditional Name: sodium 4-besyloxy-3-methoxy-besylate Formula: C13H11NaO7S2 MolecularWeight: 366.34201

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H12O7S2.Na/c1-19-13-9-11(21(14,15)16)7-8-12(13)20-22(17,18)10-5-3-2-4-6-10;/h2-9H,1H3,(H,14,15,16);/q;+1/p-1