2-(2,4,6-triphenylpyridin-1-ium-1-yl)phenoxathiine 10,10-dioxide perchlorate

Systemtic Name: 2-(2,4,6-triphenylpyridin-1-ium-1-yl)phenoxathiine 10,10-dioxide perchlorate Openeye Name: 2-(2,4,6-triphenylpyridin-1-ium-1-yl)phenoxathiine 10,10-dioxide perchlorate CAS Name: 2-(2,4,6-triphenyl-1-pyridin-1-iumyl)phenoxathiine 10,10-dioxide perchlorate IUPAC Name: 2-(2,4,6-triphenylpyridin-1-ium-1-yl)phenoxathiine 10,10-dioxide perchlorate Traditional Name: 2-(2,4,6-triphenylpyridin-1-ium-1-yl)phenoxathiine 10,10-dioxide perchlorate Formula: C35H24ClNO7S MolecularWeight: 638.08556

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=[N+](C(=C2)C3=CC=CC=C3)C4=CC5=C(C=C4)OC6=CC=CC=C6S5(=O)=O)C7=CC=CC=C7.[O-]Cl(=O)(=O)=O

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=[N+](C(=C2)C3=CC=CC=C3)C4=CC5=C(C=C4)OC6=CC=CC=C6S5(=O)=O)C7=CC=CC=C7.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C35H24NO3S.ClHO4/c37-40(38)34-19-11-10-18-32(34)39-33-21-20-29(24-35(33)40)36-30(26-14-6-2-7-15-26)22-28(25-12-4-1-5-13-25)23-31(36)27-16-8-3-9-17-27;2-1(3,4)5/h1-24H;(H,2,3,4,5)/q+1;/p-1