2-[bis(4,6-diphenylpyrylium-2-yl)methylidene]-4,6-diphenyl-pyran

Systemtic Name: 2-[bis(4,6-diphenylpyrylium-2-yl)methylidene]-4,6-diphenyl-pyran Openeye Name: 2-[bis(4,6-diphenylpyrylium-2-yl)methylene]-4,6-diphenyl-pyran CAS Name: 2-[bis(4,6-diphenyl-2-pyryliumyl)methylidene]-4,6-diphenylpyran IUPAC Name: 2-[bis(4,6-diphenylpyrylium-2-yl)methylidene]-4,6-diphenylpyran Traditional Name: 2-[bis(4,6-diphenylpyrylium-2-yl)methylene]-4,6-diphenyl-pyran Formula: C52H36O3+2 MolecularWeight: 708.84044

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=[O+]C(=C2)C(=C3C=C(C=C(O3)C4=CC=CC=C4)C5=CC=CC=C5)C6=CC(=CC(=[O+]6)C7=CC=CC=C7)C8=CC=CC=C8)C9=CC=CC=C9

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=[O+]C(=C2)C(=C3C=C(C=C(O3)C4=CC=CC=C4)C5=CC=CC=C5)C6=CC(=CC(=[O+]6)C7=CC=CC=C7)C8=CC=CC=C8)C9=CC=CC=C9

InChI

InChI=1S/C52H36O3/c1-7-19-37(20-8-1)43-31-46(40-25-13-4-14-26-40)53-49(34-43)52(50-35-44(38-21-9-2-10-22-38)32-47(54-50)41-27-15-5-16-28-41)51-36-45(39-23-11-3-12-24-39)33-48(55-51)42-29-17-6-18-30-42/h1-36H/q+2