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1H-Pyrazole-3-carboxylic acid, 4-[2-[5-[[4-chloro-6-[(4-sulfophenyl)amino]-1,3,5-triazin-2-yl]amino]-2-sulfophenyl]diazenyl]-4,5-dihydro-5-oxo-1-(4-sulfophenyl)-, sodium salt (1:4)

HCID 11971193
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Basic information

CAS
93940-70-6
Standard SMILES
O=C([O-])C1=NN(c2ccc(S(=O)(=O)[O-])cc2)C(=O)C1N=Nc1cc(Nc2nc(Cl)nc(Nc3ccc(S(=O)(=O)[O-])cc3)n2)ccc1S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]
InChIKey
UJYFKPYYLVPACP-UHFFFAOYSA-J
Molecular formula
C25H14ClN9Na4O12S3
Average molar mass
856.052 g/mol
Monoisotopic mass
854.92033469

Names & identifiers

Preferred name
1H-Pyrazole-3-carboxylic acid, 4-[2-[5-[[4-chloro-6-[(4-sulfophenyl)amino]-1,3,5-triazin-2-yl]amino]-2-sulfophenyl]diazenyl]-4,5-dihydro-5-oxo-1-(4-sulfophenyl)-, sodium salt (1:4)
English name
tetrasodium 4-[[5-[[4-chloro-6-[(4-sulphonatophenyl)amino]-1,3,5-triazin-2-yl]amino]-2-sulphonatophenyl]azo]-4,5-dihydro-5-oxo-1-(4-sulphonatophenyl)-1H-pyrazole-3-carboxylate
Molecular formula
C25H14ClN9Na4O12S3
Molecular weight
856.03884

Names & synonyms

4-[[5-[[4-Chloro-6-[(4-sulfophenyl)amino]-1,3,5-triazin-2-yl]amino]-2-sulfophenyl]azo]-4,5-dihydro-5-oxo-1-(4-sulfophenyl)-1H-pyrazole-3-carboxylic acid tetrasodium salttetrasodium 4-[[5-[[4-chloro-6-[(4-sulphonatophenyl)amino]-1,3,5-triazin-2-yl]amino]-2-sulphonatophenyl]azo]-4,5-dihydro-5-oxo-1-(4-sulphonatophenyl)-1H-pyrazole-3-carboxylate

Database identifiers

CAS
93940-70-6、94006-24-3
PubChem CID
11971193
DTXSID
DTXSID801361188
EC Number
300-468-9、301-360-4
Nikkaji
J310.468K

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