2-diazonio-5-[2,3,4-tris[(6-diazonio-5-oxidanidyl-naphthalen-1-yl)sulfonyloxy]-5-phenyl-phenoxy]sulfonyl-naphthalen-1-olate

Systemtic Name: 2-diazonio-5-[2,3,4-tris[(6-diazonio-5-oxidanidyl-naphthalen-1-yl)sulfonyloxy]-5-phenyl-phenoxy]sulfonyl-naphthalen-1-olate Openeye Name: 2-diazonio-5-[2,3,4-tris[(6-diazonio-5-oxido-1-naphthyl)sulfonyloxy]-5-phenyl-phenoxy]sulfonyl-naphthalen-1-olate CAS Name: 2-diazonio-5-[2,3,4-tris[(6-diazonio-5-oxido-1-naphthalenyl)sulfonyloxy]-5-phenylphenoxy]sulfonyl-1-naphthalenolate IUPAC Name: 2-diazonio-5-[2,3,4-tris[(6-diazonio-5-oxidonaphthalen-1-yl)sulfonyloxy]-5-phenylphenoxy]sulfonylnaphthalen-1-olate Traditional Name: 2-diazonio-5-[2,3,4-tris[(6-diazonio-5-oxido-1-naphthyl)sulfonyloxy]-5-phenyl-phenoxy]sulfonyl-naphthalen-1-olate Formula: C52H26N8O16S4 MolecularWeight: 1147.06684

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=C(C(=C2OS(=O)(=O)C3=CC=CC4=C3C=CC(=C4[O-])[N+]#N)OS(=O)(=O)C5=CC=CC6=C5C=CC(=C6[O-])[N+]#N)OS(=O)(=O)C7=CC=CC8=C7C=CC(=C8[O-])[N+]#N)OS(=O)(=O)C9=CC=CC1=C9C=CC(=C1[O-])[N+]#N

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=C(C(=C2OS(=O)(=O)C3=CC=CC4=C3C=CC(=C4[O-])[N+]#N)OS(=O)(=O)C5=CC=CC6=C5C=CC(=C6[O-])[N+]#N)OS(=O)(=O)C7=CC=CC8=C7C=CC(=C8[O-])[N+]#N)OS(=O)(=O)C9=CC=CC1=C9C=CC(=C1[O-])[N+]#N

InChI

InChI=1S/C52H26N8O16S4/c53-57-37-22-18-28-32(46(37)61)10-4-14-42(28)77(65,66)73-41-26-36(27-8-2-1-3-9-27)50(74-78(67,68)43-15-5-11-33-29(43)19-23-38(58-54)47(33)62)52(76-80(71,72)45-17-7-13-35-31(45)21-25-40(60-56)49(35)64)51(41)75-79(69,70)44-16-6-12-34-30(44)20-24-39(59-55)48(34)63/h1-26H