2,6-ditert-butyl-4-[5-(triphenylmethyl)thiophen-2-yl]pyrylium tetrafluoroborate

Systemtic Name: 2,6-ditert-butyl-4-[5-(triphenylmethyl)thiophen-2-yl]pyrylium tetrafluoroborate Openeye Name: 2,6-ditert-butyl-4-(5-trityl-2-thienyl)pyrylium tetrafluoroborate CAS Name: 2,6-ditert-butyl-4-[5-(triphenylmethyl)-2-thiophenyl]pyrylium tetrafluoroborate IUPAC Name: 2,6-ditert-butyl-4-(5-tritylthiophen-2-yl)pyrylium tetrafluoroborate Traditional Name: 2,6-ditert-butyl-4-(5-trityl-2-thienyl)pyrylium tetrafluoroborate Formula: C36H37BF4OS MolecularWeight: 604.547993

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Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.CC(C)(C)C1=CC(=CC(=[O+]1)C(C)(C)C)C2=CC=C(S2)C(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

[B-](F)(F)(F)F.CC(C)(C)C1=CC(=CC(=[O+]1)C(C)(C)C)C2=CC=C(S2)C(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C36H37OS.BF4/c1-34(2,3)31-24-26(25-32(37-31)35(4,5)6)30-22-23-33(38-30)36(27-16-10-7-11-17-27,28-18-12-8-13-19-28)29-20-14-9-15-21-29;2-1(3,4)5/h7-25H,1-6H3;/q+1;-1