Chemical Compound

J2.864.787E

J2.864.787E chemical structure
Primary Record

J2.864.787E

In stock
550 g
Purity
98.1 %

Compound Identifiers & Properties

PubChem CID
101523551
SMILES
CC(C)(C)C1=CC(=CC(=C1)C2=C3C=CC(=C(C4=CC=C(N4)C(=C5C=CC(=N5)C(=C6C=CC2=N6)C#CC7=CC=C(C=C7)C(=O)O)C8=CC(=CC(=C8)C(C)(C)C)C(C)(C)C)C#CC9=CC=C(C=C9)C#N)N3)C(C)(C)C
Canonical SMILES
CC(C)(C)c1cc(-c2c3nc(c(C#Cc4ccc(C(=O)O)cc4)c4nc(c(-c5cc(C(C)(C)C)cc(C(C)(C)C)c5)c5ccc([nH]5)c(C#Cc5ccc(C#N)cc5)c5ccc2[nH]5)C=C4)C=C3)cc(C(C)(C)C)c1

Names & Synonyms

  • J2.864.787E
  • 4-(2-{12-[2-(4-cyanophenyl)ethynyl]-7,17-bis(3,5-di-tert-butylphenyl)-21,22,23,24-tetraazapentacyclo[16.2.1.13,6.18,11.113,16]tetracosa-1,3(24),4,6,8,10,12,14,16(22),17,19-undecaen-2-yl}ethynyl)benzoic acid
  • 5-[4-Cyanophenylethynyl]-10,20-bis(3,5-di-tert-butylphenyl)-15-(4-carboxyphenylethynyl)-21H,23H-porphyrin