Chemical Compound

DTXSID901019619

CAS Registry Number 1770781-13-9
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DTXSID901019619 chemical structure
Primary Record

DTXSID901019619

In stock
7,478 g
Purity
99.7 %
CAS
1770781-13-9

Compound Identifiers & Properties

CAS
1770781-13-9
PubChem CID
154734789
SMILES
CCN(CC)CC.CC1(C(=[N+](C2=C1C3=CC=CC=C3C=C2)CCCCS(=O)(=O)[O-])/C=C/C4=C(/C(=C/C=C/5\C(C6=C(N5CCCCS(=O)(=O)O)C=CC7=CC=CC=C76)(C)C)/C8=CC=CC=C84)N(C)S(=O)(=O)C(F)(F)F)C
Canonical SMILES
CCN(CC)CC.CN(C1=C(/C=C/C2=[N+](CCCCS(=O)(=O)[O-])c3ccc4ccccc4c3C2(C)C)c2ccccc2/C1=C\C=C1\N(CCCCS(=O)(=O)O)c2ccc3ccccc3c2C1(C)C)S(=O)(=O)C(F)(F)F

Names & Synonyms

  • DTXSID901019619
  • 1770781-13-9
  • 4-(2-{(E)-2-[(1E)-1-{(2E)-2-[1,1-dimethyl-3-(4-sulfobutyl)-1,3-dihydro-2H-benzo[e]indol-2-ylidene]ethylidene}-2-{methyl[(trifluoromethyl)sulfonyl]amino}-1H-inden-3-yl]vinyl}-1,1-dimethyl-1H-benzo[e]indolium-3-yl)butane-1-sulfonate compound with N,N-diethylethanamine
  • 4-{2-[(E)-2-{(1E)-1-{(2E)-2-[1,1-Dimethyl-3-(4-sulfobutyl)-1,3-dihydro-2H-benzo[e]indol-2-ylidene]ethylidene}-2-[methyl(trifluoromethanesulfonyl)amino]-1H-inden-3-yl}ethenyl]-1,1-dimethyl-1H-benzo[e]indol-3-ium-3-yl}butane-1-sulfonate--N,N-diethylethanamine (1/1)