Products 2253710-45-9

CAS 2253710-45-9 appears in our catalog under these names: DBCO–Cyanine7, DBCO-Cyanine7, 95%, 95%. Offered by: GLPBio, Chemat. Available pack sizes: 1mg, 5mg.

Structural formula: {0} (CAS {1})

N-[3-(2-azatricyclo[10.4.0.04,9]hexadeca-1(16),4,6,8,12,14-hexaen-10-yn-2-yl)-3-oxopropyl]-6-[3,3-dimethyl-2-[7-(1,3,3-trimethylindol-1-ium-2-yl)hepta-2,4,6-trienylidene]indol-1-yl]hexanamide (CAS 2253710-45-9) is a chemical compound with the molecular formula C52H55N4O2+ and a molecular weight of 768.0 g/mol. IUPAC name: N-[3-(2-azatricyclo[10.4.0.04,9]hexadeca-1(16),4,6,8,12,14-hexaen-10-yn-2-yl)-3-oxopropyl]-6-[3,3-dimethyl-2-[7-(1,3,3-trimethylindol-1-ium-2-yl)hepta-2,4,6-trienylidene]indol-1-yl]hexanamide. InChIKey: UITMLXOTDZBDAP-UHFFFAOYSA-O.

Identity
Molecular formulaC52H55N4O2+
Molecular weight768.0 g/mol
IUPAC nameN-[3-(2-azatricyclo[10.4.0.04,9]hexadeca-1(16),4,6,8,12,14-hexaen-10-yn-2-yl)-3-oxopropyl]-6-[3,3-dimethyl-2-[7-(1,3,3-trimethylindol-1-ium-2-yl)hepta-2,4,6-trienylidene]indol-1-yl]hexanamide
InChIKeyUITMLXOTDZBDAP-UHFFFAOYSA-O
SMILESCC1(C2=CC=CC=C2[N+](=C1C=CC=CC=CC=C3C(C4=CC=CC=C4N3CCCCCC(=O)NCCC(=O)N5CC6=CC=CC=C6C#CC7=CC=CC=C75)(C)C)C)C

Computed by PubChem (NCBI)