Chemical Compound

J2.729.790K

J2.729.790K chemical structure
Primary Record

J2.729.790K

In stock
550 g
Purity
98.1 %

Compound Identifiers & Properties

PubChem CID
177448541
SMILES
CC1(C2=C(C=CC(=C2)[N+](=O)[O-])[N+](=C1/C=C/C=C/C=C\3/C(C4=C(N3CCCCCC(=O)[O-])C=CC(=C4)[N+](=O)[O-])(C)C)CCCCC#C)C
Canonical SMILES
C#CCCCC[N+]1=C(/C=C/C=C/C=C2\N(CCCCCC(=O)[O-])c3ccc([N+](=O)[O-])cc3C2(C)C)C(C)(C)c2cc([N+](=O)[O-])ccc21

Names & Synonyms

  • J2.729.790K
  • 2-{5-[1-(5-carboxylatopentyl)-3,3-dimethyl-5-nitro-2,3-dihydro-1H-indol-2-ylidene]penta-1,3-dien-1-yl}-1-(hex-5-yn-1-yl)-3,3-dimethyl-5-nitro-3H-indol-1-ium
  • 5-Nitro-1-(5-hexynyl)-2-[5-[1-(5-carboxylatopentyl)-3,3-dimethyl-5-nitro-1H-indole-2-ylidene]-1,3-pentadiene-1-yl]-3,3-dimethyl-3H-indole-1-ium