benzenesulfonate dihydrate

Systemtic Name: benzenesulfonate dihydrate Openeye Name: benzenesulfonate dihydrate CAS Name: benzenesulfonate dihydrate IUPAC Name: benzenesulfonate dihydrate Traditional Name: besylate dihydrate Formula: C6H9O5S- MolecularWeight: 193.19766

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C6H6O3S.2H2O/c7-10(8,9)6-4-2-1-3-5-6;;/h1-5H,(H,7,8,9);2*1H2/p-1