Chemical Compound

indocyanine green

CAS Registry Number 3599-32-4
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indocyanine green chemical structure
Primary Record

indocyanine green

In stock
8,235 g
Purity
98.9 %
CAS
3599-32-4

Compound Identifiers & Properties

CAS
3599-32-4
PubChem CID
50908994
SMILES
CC1(C2=C(C3=CC=CC=C3C=C2)[N+](=C1/C=C/C=C/C=C/C=C/4\C(C5=C(N4CCCCS(=O)(=O)[O-])C6=CC=CC=C6C=C5)(C)C)CCCCS(=O)(=O)[O-])C.[Na+]
Canonical SMILES
CC1(C)C(/C=C/C=C/C=C/C=C2/N(CCCCS(=O)(=O)[O-])c3c(ccc4ccccc34)C2(C)C)=[N+](CCCCS(=O)(=O)[O-])c2c1ccc1ccccc21.[Na+]

Names & Synonyms

  • indocyanine green
  • AC1NWBVM
  • 3599-32-4
  • sodium 4-[(2E)-2-[(2E,4E,6E)-7-[3,3-dimethyl-1-(4-sulfonatobutyl)benzo[g]indol-1-ium-2-yl]hepta-2,4,6-trienylidene]-3,3-dimethylbenzo[g]indol-1-yl]butane-1-sulfonate