disodium 3-oxidanyl-6-phenyl-benzene-1,2-disulfonate

Systemtic Name: disodium 3-oxidanyl-6-phenyl-benzene-1,2-disulfonate Openeye Name: disodium 3-hydroxy-6-phenyl-benzene-1,2-disulfonate CAS Name: disodium 3-hydroxy-6-phenylbenzene-1,2-disulfonate IUPAC Name: disodium 3-hydroxy-6-phenylbenzene-1,2-disulfonate Traditional Name: disodium 3-hydroxy-6-phenyl-benzene-1,2-disulfonate Formula: C12H8Na2O7S2 MolecularWeight: 374.29726

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C(=C(C=C2)O)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C(=C(C=C2)O)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]

InChI

InChI=1S/C12H10O7S2.2Na/c13-10-7-6-9(8-4-2-1-3-5-8)11(20(14,15)16)12(10)21(17,18)19;;/h1-7,13H,(H,14,15,16)(H,17,18,19);;/q;2*+1/p-2