2-phenyl-5-(2-phenylethynyl)isoindole-1,3-dione; yttrium(3+)

Systemtic Name: 2-phenyl-5-(2-phenylethynyl)isoindole-1,3-dione; yttrium(3+) Openeye Name: 2-phenyl-5-(2-phenylethynyl)isoindoline-1,3-dione; yttrium(3+) CAS Name: 2-phenyl-5-(2-phenylethynyl)isoindole-1,3-dione; yttrium(3+) IUPAC Name: 2-phenyl-5-(2-phenylethynyl)isoindole-1,3-dione; yttrium(3+) Traditional Name: 2-phenyl-5-(2-phenylethynyl)isoindoline-1,3-quinone; yttrium(3+) Formula: C22H12NO2Y+2 MolecularWeight: 411.24203

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C#CC2=CC3=C(C=C2)C(=O)N(C3=O)C4=CC=[C-]C=C4.[Y+3]

Isomeric SMILES

C1=CC=C(C=C1)C#CC2=CC3=C(C=C2)C(=O)N(C3=O)C4=CC=[C-]C=C4.[Y+3]

InChI

InChI=1S/C22H12NO2.Y/c24-21-19-14-13-17(12-11-16-7-3-1-4-8-16)15-20(19)22(25)23(21)18-9-5-2-6-10-18;/h1,3-10,13-15H;/q-1;+3