disodium 3-sulfonatobenzoate hydrate

Systemtic Name: disodium 3-sulfonatobenzoate hydrate Openeye Name: disodium 3-sulfonatobenzoate hydrate CAS Name: disodium 3-sulfonatobenzoate hydrate IUPAC Name: disodium 3-sulfonatobenzoate hydrate Traditional Name: disodium 3-sulfonatobenzoate hydrate Formula: C7H6Na2O6S MolecularWeight: 264.16348

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C7H6O5S.2Na.H2O/c8-7(9)5-2-1-3-6(4-5)13(10,11)12;;;/h1-4H,(H,8,9)(H,10,11,12);;;1H2/q;2*+1;/p-2