[2,3-bis(oxidanyl)-4-(phenylcarbonyl)phenyl] 5,6-diazido-5-oxidanyl-8-oxidanylidene-naphthalene-1-sulfonate

Systemtic Name: [2,3-bis(oxidanyl)-4-(phenylcarbonyl)phenyl] 5,6-diazido-5-oxidanyl-8-oxidanylidene-naphthalene-1-sulfonate Openeye Name: (4-benzoyl-2,3-dihydroxy-phenyl) 5,6-diazido-5-hydroxy-8-oxo-naphthalene-1-sulfonate CAS Name: 5,6-diazido-5-hydroxy-8-oxo-1-naphthalenesulfonic acid (4-benzoyl-2,3-dihydroxyphenyl) ester IUPAC Name: (4-benzoyl-2,3-dihydroxyphenyl) 5,6-diazido-5-hydroxy-8-oxonaphthalene-1-sulfonate Traditional Name: 5,6-diazido-5-hydroxy-8-keto-naphthalene-1-sulfonic acid (4-benzoyl-2,3-dihydroxy-phenyl) ester Formula: C23H14N6O8S MolecularWeight: 534.45766

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C2=C(C(=C(C=C2)OS(=O)(=O)C3=CC=CC4=C3C(=O)C=C(C4(N=[N+]=[N-])O)N=[N+]=[N-])O)O

Isomeric SMILES

C1=CC=C(C=C1)C(=O)C2=C(C(=C(C=C2)OS(=O)(=O)C3=CC=CC4=C3C(=O)C=C(C4(N=[N+]=[N-])O)N=[N+]=[N-])O)O

InChI

InChI=1S/C23H14N6O8S/c24-28-26-18-11-15(30)19-14(23(18,34)27-29-25)7-4-8-17(19)38(35,36)37-16-10-9-13(21(32)22(16)33)20(31)12-5-2-1-3-6-12/h1-11,32-34H