Chemical Compound

Sodium 4-[2-(2-{[5,6-dimethoxy-3-(3-sulfonatopropyl)-1,3-benzothiazol-2(3H)-ylidene]methyl}but-1-en-1-yl)-5-phenyl-3H-1,3-benzoxazol-1-ium-3-yl]butane-1-sulfonate

CAS Registry Number 61890-96-8
Sodium 4-[2-(2-{[5,6-dimethoxy-3-(3-sulfonatopropyl)-1,3-benzothiazol-2(3H)-ylidene]methyl}but-1-en-1-yl)-5-phenyl-3H-1,3-benzoxazol-1-ium-3-yl]butane-1-sulfonate 结构式
Primary record

Sodium 4-[2-(2-{[5,6-dimethoxy-3-(3-sulfonatopropyl)-1,3-benzothiazol-2(3H)-ylidene]methyl}but-1-en-1-yl)-5-phenyl-3H-1,3-benzoxazol-1-ium-3-yl]butane-1-sulfonate

库存
4,942 克
纯度
99.0 %
CAS
61890-96-8

化合物标识与属性

CAS
61890-96-8
PubChem CID
138400301
SMILES
CC/C(=C\C1=[N+](C2=CC(=C(C=C2S1)OC)OC)CCCS(=O)(=O)[O-])/C=C\3/N(C4=C(O3)C=CC(=C4)C5=CC=CC=C5)CCCCS(=O)(=O)[O-].[Na+]
Canonical SMILES
CCC(/C=C1\Oc2ccc(-c3ccccc3)cc2N1CCCCS(=O)(=O)[O-])=C\c1sc2cc(OC)c(OC)cc2[n+]1CCCS(=O)(=O)[O-].[Na+]

名称与同义词

  • DTXSID00977440
  • 61890-96-8
  • Sodium 4-[2-(2-{[5,6-dimethoxy-3-(3-sulfonatopropyl)-1,3-benzothiazol-2(3H)-ylidene]methyl}but-1-en-1-yl)-5-phenyl-3H-1,3-benzoxazol-1-ium-3-yl]butane-1-sulfonate