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活性橙2
Trisodium 7-(carbamoylamino)-3-{[5-({4-chloro-6-[(2-sulfonatophen yl)amino]-1,3,5-triazin-2-yl}amino)-2-sulfonatophenyl]diazenyl}-4 -hydroxy-2-naphthalenesulfonate
CAS号: 6014-69-3
IUPAC名称: trisodium;7-(carbamoylamino)-3-[[5-[[4-chloro-6-(2-sulfonatoanilino)-1,3,5-triazin-2-yl]amino]-2-sulfonatophenyl]diazenyl]-4-hydroxynaphthalene-2-sulfonate
分子式: C26H17ClN9Na3O11S3
分子量: 832.08400
InChI: InChI=1S/C26H20ClN9O11S3.3Na/c27-23-32-25(34-26(33-23)31-16-3-1-2-4-18(16)48(39,40)41)30-14-6-8-19(49(42,43)44)17(11-14)35-36-21-20(50(45,46)47)10-12-9-13(29-24(28)38)5-7-15(12)22(21)37;;;/h1-11,37H,(H3,28,29,38)(H,39,40,41)(H,42,43,44)(H,45,46,47)(H2,30,31,32,33,34);;;/q;3*+1/p-3
InChIKey: FRGGJERTMGHKNC-UHFFFAOYSA-K
SMILES: C1=CC=C(C(=C1)NC2=NC(=NC(=N2)NC3=CC(=C(C=C3)S(=O)(=O)[O-])N=NC4=C(C=C5C=C(C=CC5=C4O)NC(=O)N)S(=O)(=O)[O-])Cl)S(=O)(=O)[O-].[Na+].[Na+].[Na+]
EINECS: -
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