disodium; cyclohexa-1,3-diene; cyclohexa-1,3-diene-1,3-disulfonate

Systemtic Name: disodium; cyclohexa-1,3-diene; cyclohexa-1,3-diene-1,3-disulfonate Openeye Name: disodium; cyclohexa-1,3-diene; cyclohexa-1,3-diene-1,3-disulfonate CAS Name: disodium; cyclohexa-1,3-diene; cyclohexa-1,3-diene-1,3-disulfonate IUPAC Name: disodium; cyclohexa-1,3-diene; cyclohexa-1,3-diene-1,3-disulfonate Traditional Name: disodium; cyclohexa-1,3-diene; cyclohexa-1,3-diene-1,3-disulfonate Formula: C12H14Na2O6S2 MolecularWeight: 364.3455

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Descriptors Computed from Structure

Canonical SMILES:

C1CC=CC=C1.C1CC(=CC(=C1)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]

Isomeric SMILES

C1CC=CC=C1.C1CC(=CC(=C1)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]

InChI

InChI=1S/C6H8O6S2.C6H8.2Na/c7-13(8,9)5-2-1-3-6(4-5)14(10,11)12;1-2-4-6-5-3-1;;/h2,4H,1,3H2,(H,7,8,9)(H,10,11,12);1-4H,5-6H2;;/q;;2*+1/p-2