6-[4-[2-[4-(3-diazonio-2-oxidanyl-4-oxidanylidene-chromen-6-yl)sulfonyloxyphenyl]propan-2-yl]phenoxy]sulfonyl-2-oxidanyl-4-oxidanylidene-chromene-3-diazonium

Systemtic Name: 6-[4-[2-[4-(3-diazonio-2-oxidanyl-4-oxidanylidene-chromen-6-yl)sulfonyloxyphenyl]propan-2-yl]phenoxy]sulfonyl-2-oxidanyl-4-oxidanylidene-chromene-3-diazonium Openeye Name: 6-[4-[1-[4-(3-diazonio-2-hydroxy-4-oxo-chromen-6-yl)sulfonyloxyphenyl]-1-methyl-ethyl]phenoxy]sulfonyl-2-hydroxy-4-oxo-chromene-3-diazonium CAS Name: 6-[4-[2-[4-[(3-diazonio-2-hydroxy-4-oxo-1-benzopyran-6-yl)sulfonyloxy]phenyl]propan-2-yl]phenoxy]sulfonyl-2-hydroxy-4-oxo-1-benzopyran-3-diazonium IUPAC Name: 6-[4-[2-[4-(3-diazonio-2-hydroxy-4-oxochromen-6-yl)sulfonyloxyphenyl]propan-2-yl]phenoxy]sulfonyl-2-hydroxy-4-oxochromene-3-diazonium Traditional Name: 6-[4-[1-[4-(3-diazonio-2-hydroxy-4-keto-chromen-6-yl)sulfonyloxyphenyl]-1-methyl-ethyl]phenoxy]sulfonyl-2-hydroxy-4-keto-chromene-3-diazonium Formula: C33H22N4O12S2+2 MolecularWeight: 730.67738

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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/p+2