2-diazonio-4-[3-(3-diazonio-4-oxidanidyl-naphthalen-1-yl)sulfonyloxy-4-(phenylcarbonyl)phenoxy]sulfonyl-naphthalen-1-olate

Systemtic Name: 2-diazonio-4-[3-(3-diazonio-4-oxidanidyl-naphthalen-1-yl)sulfonyloxy-4-(phenylcarbonyl)phenoxy]sulfonyl-naphthalen-1-olate Openeye Name: 4-[4-benzoyl-3-[(3-diazonio-4-oxido-1-naphthyl)sulfonyloxy]phenoxy]sulfonyl-2-diazonio-naphthalen-1-olate CAS Name: 4-[4-benzoyl-3-[(3-diazonio-4-oxido-1-naphthalenyl)sulfonyloxy]phenoxy]sulfonyl-2-diazonio-1-naphthalenolate IUPAC Name: 4-[4-benzoyl-3-(3-diazonio-4-oxidonaphthalen-1-yl)sulfonyloxyphenoxy]sulfonyl-2-diazonionaphthalen-1-olate Traditional Name: 4-[4-benzoyl-3-[(3-diazonio-4-oxido-1-naphthyl)sulfonyloxy]phenoxy]sulfonyl-2-diazonio-naphthalen-1-olate Formula: C33H18N4O9S2 MolecularWeight: 678.64742

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C2=C(C=C(C=C2)OS(=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

Isomeric SMILES

C1=CC=C(C=C1)C(=O)C2=C(C=C(C=C2)OS(=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

InChI

InChI=1S/C33H18N4O9S2/c34-36-26-17-29(21-10-4-6-12-23(21)32(26)39)47(41,42)45-20-14-15-25(31(38)19-8-2-1-3-9-19)28(16-20)46-48(43,44)30-18-27(37-35)33(40)24-13-7-5-11-22(24)30/h1-18H