3-oxidanyl-6-[tris(oxidanyl)-$l^{4}-sulfanyl]pyrene-1,8-disulfonic acid

Systemtic Name: 3-oxidanyl-6-[tris(oxidanyl)-$l^{4}-sulfanyl]pyrene-1,8-disulfonic acid Openeye Name: 3-hydroxy-6-(trihydroxy-$l^{4}-sulfanyl)pyrene-1,8-disulfonic acid CAS Name: 3-hydroxy-6-(trihydroxy-$l^{4}-sulfanyl)pyrene-1,8-disulfonic acid IUPAC Name: 3-hydroxy-6-(trihydroxy-$l^{4}-sulfanyl)pyrene-1,8-disulfonic acid Traditional Name: 3-hydroxy-6-trihydroxysulfuranyl-pyrene-1,8-disulfonic acid Formula: C16H12O10S3 MolecularWeight: 460.45548

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C(C3=C2C4=C1C(=CC(=C4C=C3)S(=O)(=O)O)O)S(=O)(=O)O)S(O)(O)O

Isomeric SMILES

C1=CC2=C(C=C(C3=C2C4=C1C(=CC(=C4C=C3)S(=O)(=O)O)O)S(=O)(=O)O)S(O)(O)O

InChI

InChI=1S/C16H12O10S3/c17-11-5-12(27(18,19)20)8-3-4-10-14(29(24,25)26)6-13(28(21,22)23)9-2-1-7(11)15(8)16(9)10/h1-6,17,21-23H,(H,18,19,20)(H,24,25,26)