4-[(E)-(4,6-diphenylthiopyran-2-ylidene)methyl]-2,6-diphenyl-pyrylium perchlorate

Systemtic Name: 4-[(E)-(4,6-diphenylthiopyran-2-ylidene)methyl]-2,6-diphenyl-pyrylium perchlorate Openeye Name: 4-[(E)-(4,6-diphenylthiopyran-2-ylidene)methyl]-2,6-diphenyl-pyrylium perchlorate CAS Name: 4-[(E)-(4,6-diphenyl-2-thiopyranylidene)methyl]-2,6-diphenylpyrylium perchlorate IUPAC Name: 4-[(E)-(4,6-diphenylthiopyran-2-ylidene)methyl]-2,6-diphenylpyrylium perchlorate Traditional Name: 4-[(E)-(4,6-diphenylthiopyran-2-ylidene)methyl]-2,6-diphenyl-pyrylium perchlorate Formula: C35H25ClO5S MolecularWeight: 593.088

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=CC3=CC(=[O+]C(=C3)C4=CC=CC=C4)C5=CC=CC=C5)SC(=C2)C6=CC=CC=C6.[O-]Cl(=O)(=O)=O

Isomeric SMILES

C1=CC=C(C=C1)C2=C/C(=C\C3=CC(=[O+]C(=C3)C4=CC=CC=C4)C5=CC=CC=C5)/SC(=C2)C6=CC=CC=C6.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C35H25OS.ClHO4/c1-5-13-27(14-6-1)31-24-32(37-35(25-31)30-19-11-4-12-20-30)21-26-22-33(28-15-7-2-8-16-28)36-34(23-26)29-17-9-3-10-18-29;2-1(3,4)5/h1-25H;(H,2,3,4,5)/q+1;/p-1/b32-21+;