3H-Indolium, 2-[2-[4-[(2-cyanoethyl)methylamino]phenyl]ethenyl]-1,3,3-trimethyl-, phosphate

Catalog No. :
ACDJWT864
CAS No. :
72208-21-0
Molecular Formula :
C69H78N9O4P
Molecular Weight :
1128.42

IUPAC Name:(E)-2-(4-((2-cyanoethyl)(methyl)amino)styryl)-1,3,3-trimethyl-3H-indol-1-ium phosphate

3H-Indolium, 2-[2-[4-[(2-cyanoethyl)methylamino]phenyl]ethenyl]-1,3,3-trimethyl-, phosphate structure diagram
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Product Information

Product Name3H-Indolium, 2-[2-[4-[(2-cyanoethyl)methylamino]phenyl]ethenyl]-1,3,3-trimethyl-, phosphate
IUPAC Name(E)-2-(4-((2-cyanoethyl)(methyl)amino)styryl)-1,3,3-trimethyl-3H-indol-1-ium phosphate
Molecular FormulaC69H78N9O4P
Molecular Weight1128.42
SMILESCN(CCC#N)C1=CC=C(/C=C/C2=[N+](C)C3=C(C=CC=C3)C2(C)C)C=C1.CN(CCC#N)C1=CC=C(/C=C/C2=[N+](C)C3=C(C=CC=C3)C2(C)C)C=C1.CN(CCC#N)C1=CC=C(/C=C/C2=[N+](C)C3=C(C=CC=C3)C2(C)C)C=C1.O=P([O-])([O-])[O-]
InChI KeyHVQJBHGBNJVXIT-UHFFFAOYSA-K
Synonym2-[2-[4-[(2-cyanoethyl)methylamino]phenyl]vinyl]-1,3,3-trimethyl-3H-indolium dihydrogen phosphate;C.I. Basic Red 14 phosphate;3H-Indolium, 2-2-4-(2-cyanoethyl)methylaminophenylethenyl-1,3,3-trimethyl-, phosphate (1:1)
CAS No.72208-21-0

Synthetic Route by SureRoute

1. ACDJWT864 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
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  3. reactant_2 route compound structure diagram
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  4. Then
  5. ACDJWT864 route product structure diagram
    ACDJWT86472208-21-0
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2. ACDJWT864 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
    --
  2. Plus
  3. reactant_2 route compound structure diagram
    --
  4. Then
  5. ACDJWT864 route product structure diagram
    ACDJWT86472208-21-0
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