Products 2417507-09-4

CAS 2417507-09-4 appears in our catalog under these names: SMCy5·5, SMCy5.5, 95.0%. Offered by: GLPBio, MedChemExpress. Available pack sizes: 10mg, 5mg, 10 mg, 5 mg, 50 mg, 25 mg.

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

8,10-dicyclohexyl-5-[5-(1,1-dimethyl-3-pent-4-ynylbenzo[e]indol-3-ium-2-yl)penta-2,4-dienylidene]-3,3-difluoro-2,4-dioxa-8,10-diaza-3-boranuidabicyclo[4.4.0]dec-1(6)-ene-7,9-dione (CAS 2417507-09-4) is a chemical compound with the molecular formula C41H46BF2N3O4 and a molecular weight of 693.6 g/mol. IUPAC name: 8,10-dicyclohexyl-5-[5-(1,1-dimethyl-3-pent-4-ynylbenzo[e]indol-3-ium-2-yl)penta-2,4-dienylidene]-3,3-difluoro-2,4-dioxa-8,10-diaza-3-boranuidabicyclo[4.4.0]dec-1(6)-ene-7,9-dione. InChIKey: CCEAGIQCUXUBGY-UHFFFAOYSA-N.

Identity
Molecular formulaC41H46BF2N3O4
Molecular weight693.6 g/mol
IUPAC name8,10-dicyclohexyl-5-[5-(1,1-dimethyl-3-pent-4-ynylbenzo[e]indol-3-ium-2-yl)penta-2,4-dienylidene]-3,3-difluoro-2,4-dioxa-8,10-diaza-3-boranuidabicyclo[4.4.0]dec-1(6)-ene-7,9-dione
InChIKeyCCEAGIQCUXUBGY-UHFFFAOYSA-N
SMILES[B-]1(OC(=CC=CC=CC2=[N+](C3=C(C2(C)C)C4=CC=CC=C4C=C3)CCCC#C)C5=C(O1)N(C(=O)N(C5=O)C6CCCCC6)C7CCCCC7)(F)F

Computed by PubChem (NCBI)

Synonyms: SMCy 5.5