1-[(5-Carboxy-1,3-dihydro-3,3-dimethyl-1-octyl-2H-indol-2-ylidene)methyl]-3-[(3-ethyl-1,3-dihydro-1,1-dimethyl-2H-benz[e]indol-2-ylidene)methyl]-2,4-dihydroxy-Cyclobutenediylium bis(inner salt)

Catalog No. :
ACLSXQ648
CAS No. :
1240041-84-2
Molecular Formula :
C41H46N2O4
Molecular Weight :
630.83

IUPAC Name:3-((5-carboxy-3,3-dimethyl-1-octylindolin-2-ylidene)methyl)-1-((3-ethyl-1,1-dimethyl-1,3-dihydro-2H-benzo[e]indol-2-ylidene)methyl)-4-oxocyclobut-2-en-1-ylium-2-olate

1-[(5-Carboxy-1,3-dihydro-3,3-dimethyl-1-octyl-2H-indol-2-ylidene)methyl]-3-[(3-ethyl-1,3-dihydro-1,1-dimethyl-2H-benz[e]indol-2-ylidene)methyl]-2,4-dihydroxy-Cyclobutenediylium bis(inner salt) structure diagram
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Product Information

Product Name1-[(5-Carboxy-1,3-dihydro-3,3-dimethyl-1-octyl-2H-indol-2-ylidene)methyl]-3-[(3-ethyl-1,3-dihydro-1,1-dimethyl-2H-benz[e]indol-2-ylidene)methyl]-2,4-dihydroxy-Cyclobutenediylium bis(inner salt)
IUPAC Name3-((5-carboxy-3,3-dimethyl-1-octylindolin-2-ylidene)methyl)-1-((3-ethyl-1,1-dimethyl-1,3-dihydro-2H-benzo[e]indol-2-ylidene)methyl)-4-oxocyclobut-2-en-1-ylium-2-olate
Molecular FormulaC41H46N2O4
Molecular Weight630.83
SMILES[O-][C+]1[C+](C=C2N(CC)C3=C(C4=CC=CC=C4C=C3)C2(C)C)C([O-])=C1C=C5N(CCCCCCCC)C6=C(C=C(C(O)=O)C=C6)C5(C)C
InChI KeyLJLFTBVPEPLLMD-UHFFFAOYSA-N
Synonym( E )-4-((5-carboxy-3,3-diMethyl-1-octyl-3H-indoliuM-2-yl)Methylene)-2-((E )-(3-ethyl-1,1-diMethyl-1H-benzo[e]indol-2(3H)-ylidene)Methyl)-3-oxocyclobut-1-enolate;SQ02;Cyclobutenediylium, 1-[(5-carboxy-1,3-dihydro-3,3-dimethyl-1-octyl-2H-indol-2-ylidene)methyl]-3-[(3-ethyl-1,3-dihydro-1,1-dimethyl-2H-benz[e]indol-2-ylidene)methyl]-2,4-dihydroxy-, bis(inner salt)
CAS No.1240041-84-2

Synthetic Route by SureRoute

1. ACLSXQ648 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
    --
  2. Then
  3. ACLSXQ648 route product structure diagram
    ACLSXQ6481240041-84-2
Inquiry

2. ACLSXQ648 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
    --
  2. Then
  3. ACLSXQ648 route product structure diagram
    ACLSXQ6481240041-84-2
Inquiry

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