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Basic information
- CAS
16760-11-5- Standard SMILES
C[n+]1cccc(NC(=O)c2ccc(NC(=O)c3ccc(C(=O)Nc4ccc(C(=O)Nc5ccc[n+](C)c5)cc4)c(Cl)c3)cc2)c1.Cc1ccc(S(=O)(=O)[O-])cc1.Cc1ccc(S(=O)(=O)[O-])cc1- InChIKey
IPCGCJALEYQIOV-UHFFFAOYSA-N- Molecular formula
- C48H43ClN6O10S2
- Average molar mass
- 963.491 g/mol
- Monoisotopic mass
- 962.21706126
Names & identifiers
- Preferred name
- Pyridinium, 3,3'-(2-chloroterephthaloylbis(imino-p-phenylenecarbonylimino))bis(1-methyl-, di-p-toluenesulfonate
- IUPAC
- 3,3'-[(2-Chloro-1,4-phenylene)bis(carbonylazanediyl-4,1-phenylenecarbonylazanediyl)]bis(1-methylpyridin-1-ium) bis(4-methylbenzene-1-sulfonate)
Database identifiers
- CAS
16760-11-5- PubChem CID
- 204643
- DTXSID
DTXSID40168330- ChEMBL
CHEMBL3230688
Related reactions
0 records
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Compound notes
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