Search Result : Detailed Informations
| Low Mol Weight Allergen Name |
CAS# |
CID |
| FD&C Blue No. 2 / CI Food blue 1 / Indigo carmine / Indigotine / C.I. 73015 / Sodium indigotindisulfonate |
860-22-0
|
44134776
|
| Structure |
Other Information |
|
| Canonical SMILES |
C1=CC2=C(C=C1S(=O)(=O)[O-])C(=O)C(=C3C(=O)C4=C(N3)C=CC(=C4)S(=O)(=O)[O-])N2.[Na+].[Na+]
|
| Iso SMILES |
C1=CC2=C(C=C1S(=O)(=O)[O-])C(=O)C(=C3C(=O)C4=C(N3)C=CC(=C4)S(=O)(=O)[O-])N2.[Na+].[Na+]
|
| InChI |
InChI=1S/C16H10N2O8S2.2Na/c19-15-9-5-7(27(21,22)23)1-3-11(9)17-13(15)14-16(20)10-6-8(28(24,25)26)2-4-12(10)18-14;;/h1-6,17-18H,(H,21,22,23)(H,24,25,26);;/q;2*+1/p-2
|
| InChI Key |
KHLVKKOJDHCJMG-UHFFFAOYSA-L
|
| Formula |
C16H8N2Na2O8S2
|
| Mol Weight |
466.353 |
| XlogP3 |
0 |
| Charge |
0 |
|
Click structure image, you can go to pubchem link...
| Synonyms Information |
| CAS Name |
disodium 3-oxo-2-(3-oxo-5-sulfonato-1H-indol-2-ylidene)-1H-indole-5-sulfonate |
| IUPAC Name |
disodium 3-oxo-2-(3-oxo-5-sulfonato-indolin-2-ylidene)indoline-5-sulfonate |
| Openeye Name |
disodium 3-oxo-2-(3-oxo-5-sulfonato-1H-indol-2-ylidene)-1H-indole-5-sulfonate |
| Systematic Name |
disodium 3-oxidanylidene-2-(3-oxidanylidene-5-sulfonato-1H-indol-2-ylidene)-1H-indole-5-sulfonate |
| Tratitional Name |
disodium 3-oxidanylidene-2-(3-oxidanylidene-5-sulfonato-1H-indol-2-ylidene)-1H-indole-5-sulfonate |
|
