6,8-bis(oxidanyl)pyrene-1,3-disulfonic acid

Systemtic Name: 6,8-bis(oxidanyl)pyrene-1,3-disulfonic acid Openeye Name: 6,8-dihydroxypyrene-1,3-disulfonic acid CAS Name: 6,8-dihydroxypyrene-1,3-disulfonic acid IUPAC Name: 6,8-dihydroxypyrene-1,3-disulfonic acid Traditional Name: 6,8-dihydroxypyrene-1,3-disulfonic acid Formula: C16H10O8S2 MolecularWeight: 394.3758

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C3C(=C(C=C2S(=O)(=O)O)S(=O)(=O)O)C=CC4=C(C=C(C1=C43)O)O

Isomeric SMILES

C1=CC2=C3C(=C(C=C2S(=O)(=O)O)S(=O)(=O)O)C=CC4=C(C=C(C1=C43)O)O

InChI

InChI=1S/C16H10O8S2/c17-11-5-12(18)8-2-4-10-14(26(22,23)24)6-13(25(19,20)21)9-3-1-7(11)15(8)16(9)10/h1-6,17-18H,(H,19,20,21)(H,22,23,24)