disodium 4-(4-sulfonatophenyl)benzoate

Systemtic Name: disodium 4-(4-sulfonatophenyl)benzoate Openeye Name: disodium 4-(4-sulfonatophenyl)benzoate CAS Name: disodium 4-(4-sulfonatophenyl)benzoate IUPAC Name: disodium 4-(4-sulfonatophenyl)benzoate Traditional Name: disodium 4-(4-sulfonatophenyl)benzoate Formula: C13H8Na2O5S MolecularWeight: 322.24416

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=CC=C(C=C2)S(=O)(=O)[O-])C(=O)[O-].[Na+].[Na+]

Isomeric SMILES

C1=CC(=CC=C1C2=CC=C(C=C2)S(=O)(=O)[O-])C(=O)[O-].[Na+].[Na+]

InChI

InChI=1S/C13H10O5S.2Na/c14-13(15)11-3-1-9(2-4-11)10-5-7-12(8-6-10)19(16,17)18;;/h1-8H,(H,14,15)(H,16,17,18);;/q;2*+1/p-2