disodium benzenesulfonic acid sulfate

Systemtic Name: disodium benzenesulfonic acid sulfate Openeye Name: disodium benzenesulfonic acid sulfate CAS Name: disodium benzenesulfonic acid sulfate IUPAC Name: disodium benzenesulfonic acid sulfate Traditional Name: disodium besylic acid sulfate Formula: C12H12Na2O10S3 MolecularWeight: 458.39222

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/2C6H6O3S.2Na.H2O4S/c2*7-10(8,9)6-4-2-1-3-5-6;;;1-5(2,3)4/h2*1-5H,(H,7,8,9);;;(H2,1,2,3,4)/q;;2*+1;/p-2