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74727-37-0

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Basic Information
CAS No.: 74727-37-0
Name: tetrasodium [(9,10-dihydro-9,10-dioxoanthracene-2,6-diyl)bis(sulphonylimino)]bismethanesulphonate
Molecular Structure:
Molecular Structure of 74727-37-0 (tetrasodium [(9,10-dihydro-9,10-dioxoanthracene-2,6-diyl)bis(sulphonylimino)]bismethanesulphonate)
Formula: C32H24N4Na4O24S8
Molecular Weight: 1197.02
Synonyms: tetrasodium [(9,10-dihydro-9,10-dioxoanthracene-2,6-diyl)bis(sulphonylimino)]bismethanesulphonate;tetrasodium [[9,10-dioxo-6-(sulfonatomethylsulfamoyl)-2-anthryl]sulfonylamino]methanesulfonate;
EINECS: 277-975-6
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Specification

The Methanesulfonic acid,[(9,10-dihydro-9,10-dioxo-2,6-anthracenediyl)bis(sulfonylimino)]bis-,tetrasodium salt (9CI), with the CAS registry number 74727-37-0, is also known as Tetrasodium [(9,10-dihydro-9,10-dioxoanthracene-2,6-diyl)bis(sulphonylimino)]bismethanesulphonate. Its EINECS number is 277-975-6. This chemical's molecular formula is C32H24N4Na4O24S8 and molecular weight is 1197.02. What's more, its systematic name is tetrasodium [[9,10-dioxo-6-(sulfonatomethylsulfamoyl)-2-anthryl]sulfonylamino]methanesulfonate. 

Physical properties of Methanesulfonic acid,[(9,10-dihydro-9,10-dioxo-2,6-anthracenediyl)bis(sulfonylimino)]bis-,tetrasodium salt (9CI) are: (1)#H bond acceptors: 28; (2)#H bond donors: 8; (3)#Freely Rotating Bonds: 12; (4)Polar Surface Area: 548.8 Å2.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: [Na+].[Na+].[Na+].[Na+].[O-]S(=O)(=O)CNS(=O)(=O)c2ccc3C(=O)c1cc(ccc1C(=O)c3c2)S(=O)(=O)NCS([O-])(=O)=O.[O-]S(=O)(=O)CNS(=O)(=O)c2ccc3C(=O)c1cc(ccc1C(=O)c3c2)S(=O)(=O)NCS([O-])(=O)=O
(2)InChI: InChI=1/2C16H14N2O12S4.4Na/c2*19-15-11-3-1-9(33(27,28)17-7-31(21,22)23)5-13(11)16(20)12-4-2-10(6-14(12)15)34(29,30)18-8-32(24,25)26;;;;/h2*1-6,17-18H,7-8H2,(H,21,22,23)(H,24,25,26);;;;/q;;4*+1/p-4
(3)InChIKey: VIBJMBGJCMAOIO-XBHQNQODAV