Search Result : Detailed Informations
Low Mol Weight Allergen Name Acid yellow 3 / Quinoline yellow / C.I. 47005 / CI food yellow 13 / D&C Yellow no. 10
CAS# 8004-92-0
CID 24671

Structure Other Information
Canonical SMILES C1=CC=C2C(=C1)C(=O)C(C2=O)C3=NC4=C(C=C(C=C4C=C3)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]
Iso SMILES C1=CC=C2C(=C1)C(=O)C(C2=O)C3=NC4=C(C=C(C=C4C=C3)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]
InChI InChI=1S/C18H11NO8S2.2Na/c20-17-11-3-1-2-4-12(11)18(21)15(17)13-6-5-9-7-10(28(22,23)24)8-14(16(9)19-13)29(25,26)27;;/h1-8,15H,(H,22,23,24)(H,25,26,27);;/q;2*+1/p-2
InChI Key FZUOVNMHEAPVBW-UHFFFAOYSA-L
Formula C18H9NNa2O8S2
Mol Weight 477.375
XlogP3 0
Charge 0
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Synonyms Information
CAS Name disodium 2-(1,3-dioxo-2-indenyl)quinoline-6,8-disulfonate
IUPAC Name disodium 2-(1,3-dioxoindan-2-yl)quinoline-6,8-disulfonate
Openeye Name disodium 2-(1,3-dioxoinden-2-yl)quinoline-6,8-disulfonate
Systematic Name disodium 2-[1,3-bis(oxidanylidene)inden-2-yl]quinoline-6,8-disulfonate
Tratitional Name disodium 2-[1,3-bis(oxidanylidene)inden-2-yl]quinoline-6,8-disulfonate

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