disodium 4-ethylbenzene-1,3-disulfonate

Systemtic Name: disodium 4-ethylbenzene-1,3-disulfonate Openeye Name: disodium 4-ethylbenzene-1,3-disulfonate CAS Name: disodium 4-ethylbenzene-1,3-disulfonate IUPAC Name: disodium 4-ethylbenzene-1,3-disulfonate Traditional Name: disodium 4-ethylbenzene-1,3-disulfonate Formula: C8H8Na2O6S2 MolecularWeight: 310.25506

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C=C1)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]

Isomeric SMILES

CCC1=C(C=C(C=C1)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]

InChI

InChI=1S/C8H10O6S2.2Na/c1-2-6-3-4-7(15(9,10)11)5-8(6)16(12,13)14;;/h3-5H,2H2,1H3,(H,9,10,11)(H,12,13,14);;/q;2*+1/p-2