disodium 1-phenylethane-1,2-disulfonate

Systemtic Name: disodium 1-phenylethane-1,2-disulfonate Openeye Name: disodium 1-phenylethane-1,2-disulfonate CAS Name: disodium 1-phenylethane-1,2-disulfonate IUPAC Name: disodium 1-phenylethane-1,2-disulfonate Traditional Name: disodium 1-phenylethane-1,2-disulfonate Formula: C8H8Na2O6S2 MolecularWeight: 310.25506

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H10O6S2.2Na/c9-15(10,11)6-8(16(12,13)14)7-4-2-1-3-5-7;;/h1-5,8H,6H2,(H,9,10,11)(H,12,13,14);;/q;2*+1/p-2