3-diazonio-6-[4-[2-[4-(3-diazonio-2-oxidanidyl-4-oxidanylidene-chromen-6-yl)sulfonyloxyphenyl]propan-2-yl]phenoxy]sulfonyl-4-oxidanylidene-chromen-2-olate

Systemtic Name: 3-diazonio-6-[4-[2-[4-(3-diazonio-2-oxidanidyl-4-oxidanylidene-chromen-6-yl)sulfonyloxyphenyl]propan-2-yl]phenoxy]sulfonyl-4-oxidanylidene-chromen-2-olate Openeye Name: 3-diazonio-6-[4-[1-[4-(3-diazonio-2-oxido-4-oxo-chromen-6-yl)sulfonyloxyphenyl]-1-methyl-ethyl]phenoxy]sulfonyl-4-oxo-chromen-2-olate CAS Name: 3-diazonio-6-[4-[2-[4-[(3-diazonio-2-oxido-4-oxo-1-benzopyran-6-yl)sulfonyloxy]phenyl]propan-2-yl]phenoxy]sulfonyl-4-oxo-1-benzopyran-2-olate IUPAC Name: 3-diazonio-6-[4-[2-[4-(3-diazonio-2-oxido-4-oxochromen-6-yl)sulfonyloxyphenyl]propan-2-yl]phenoxy]sulfonyl-4-oxochromen-2-olate Traditional Name: 3-diazonio-6-[4-[1-[4-(3-diazonio-4-keto-2-oxido-chromen-6-yl)sulfonyloxyphenyl]-1-methyl-ethyl]phenoxy]sulfonyl-4-keto-chromen-2-olate Formula: C33H20N4O12S2 MolecularWeight: 728.6615

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CC=C(C=C1)OS(=O)(=O)C2=CC3=C(C=C2)OC(=C(C3=O)[N+]#N)[O-])C4=CC=C(C=C4)OS(=O)(=O)C5=CC6=C(C=C5)OC(=C(C6=O)[N+]#N)[O-]

Isomeric SMILES

CC(C)(C1=CC=C(C=C1)OS(=O)(=O)C2=CC3=C(C=C2)OC(=C(C3=O)[N+]#N)[O-])C4=CC=C(C=C4)OS(=O)(=O)C5=CC6=C(C=C5)OC(=C(C6=O)[N+]#N)[O-]

InChI

InChI=1S/C33H20N4O12S2/c1-33(2,17-3-7-19(8-4-17)48-50(42,43)21-11-13-25-23(15-21)29(38)27(36-34)31(40)46-25)18-5-9-20(10-6-18)49-51(44,45)22-12-14-26-24(16-22)30(39)28(37-35)32(41)47-26/h3-16H,1-2H3