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

Systemtic Name: 2-diazonio-4-[2,3,4-tris[(3-diazonio-4-oxidanidyl-naphthalen-1-yl)sulfonyloxy]-5-phenyl-phenoxy]sulfonyl-naphthalen-1-olate Openeye Name: 2-diazonio-4-[2,3,4-tris[(3-diazonio-4-oxido-1-naphthyl)sulfonyloxy]-5-phenyl-phenoxy]sulfonyl-naphthalen-1-olate CAS Name: 2-diazonio-4-[2,3,4-tris[(3-diazonio-4-oxido-1-naphthalenyl)sulfonyloxy]-5-phenylphenoxy]sulfonyl-1-naphthalenolate IUPAC Name: 2-diazonio-4-[2,3,4-tris[(3-diazonio-4-oxidonaphthalen-1-yl)sulfonyloxy]-5-phenylphenoxy]sulfonylnaphthalen-1-olate Traditional Name: 2-diazonio-4-[2,3,4-tris[(3-diazonio-4-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(=C(C4=CC=CC=C43)[O-])[N+]#N)OS(=O)(=O)C5=CC(=C(C6=CC=CC=C65)[O-])[N+]#N)OS(=O)(=O)C7=CC(=C(C8=CC=CC=C87)[O-])[N+]#N)OS(=O)(=O)C9=CC(=C(C1=CC=CC=C19)[O-])[N+]#N

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=C(C(=C2OS(=O)(=O)C3=CC(=C(C4=CC=CC=C43)[O-])[N+]#N)OS(=O)(=O)C5=CC(=C(C6=CC=CC=C65)[O-])[N+]#N)OS(=O)(=O)C7=CC(=C(C8=CC=CC=C87)[O-])[N+]#N)OS(=O)(=O)C9=CC(=C(C1=CC=CC=C19)[O-])[N+]#N

InChI

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