Search Result : Detailed Informations

Low Mol Weight Allergen Name CAS# CID
C.I. 16255 / CI food red 7 51811-48-4 6364568

Structure Other Information
Canonical SMILES C1=CC=C2C(=C1)C(=CC=C2S(=O)(=O)[O-])NN=C3C(=O)C=CC4=CC(=CC(=C43)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]
Iso SMILES C1=CC=C2C(=C1)C(=CC=C2S(=O)(=O)[O-])NN=C3C(=O)C=CC4=CC(=CC(=C43)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]
InChI InChI=1S/C20H14N2O10S3.3Na/c23-16-7-5-11-9-12(33(24,25)26)10-18(35(30,31)32)19(11)20(16)22-21-15-6-8-17(34(27,28)29)14-4-2-1-3-13(14)15;;;/h1-10,21H,(H,24,25,26)(H,27,28,29)(H,30,31,32);;;/q;3*+1/p-3
InChI Key IVNZBWNBYXERPK-UHFFFAOYSA-K
Formula C20H11N2Na3O10S3
Mol Weight 604.473
XlogP3 0
Charge 0

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Synonyms Information
CAS Name trisodium 7-oxo-8-[(4-sulfonato-1-naphthalenyl)hydrazinylidene]naphthalene-1,3-disulfonate
IUPAC Name trisodium 7-oxo-8-[(4-sulfonato-1-naphthyl)hydrazono]naphthalene-1,3-disulfonate
Openeye Name trisodium 7-oxo-8-[(4-sulfonatonaphthalen-1-yl)hydrazinylidene]naphthalene-1,3-disulfonate
Systematic Name trisodium 7-oxidanylidene-8-[(4-sulfonatonaphthalen-1-yl)hydrazinylidene]naphthalene-1,3-disulfonate
Tratitional Name trisodium 7-oxidanylidene-8-[(4-sulfonatonaphthalen-1-yl)hydrazinylidene]naphthalene-1,3-disulfonate