bismuth; benzene; 2-oxidanidyl-5-sulfonato-benzoate; hydrate

Systemtic Name: bismuth; benzene; 2-oxidanidyl-5-sulfonato-benzoate; hydrate Openeye Name: bismuth; benzene; 2-oxido-5-sulfonato-benzoate; hydrate CAS Name: bismuth; benzene; 2-oxido-5-sulfonatobenzoate; hydrate IUPAC Name: bismuth; benzene; 2-oxido-5-sulfonatobenzoate; hydrate Traditional Name: bismuth; benzene; 2-oxido-5-sulfonato-benzoate; hydrate Formula: C13H11BiO7S MolecularWeight: 520.26762

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=CC=C1.C1=CC(=C(C=C1S(=O)(=O)[O-])C(=O)[O-])[O-].O.[Bi+3]

Isomeric SMILES

C1=CC=CC=C1.C1=CC(=C(C=C1S(=O)(=O)[O-])C(=O)[O-])[O-].O.[Bi+3]

InChI

InChI=1S/C7H6O6S.C6H6.Bi.H2O/c8-6-2-1-4(14(11,12)13)3-5(6)7(9)10;1-2-4-6-5-3-1;;/h1-3,8H,(H,9,10)(H,11,12,13);1-6H;;1H2/q;;+3;/p-3