2-(2,4,6-triphenylpyridin-1-ium-1-yl)propane-1,3-diol perchlorate

Systemtic Name: 2-(2,4,6-triphenylpyridin-1-ium-1-yl)propane-1,3-diol perchlorate Openeye Name: 2-(2,4,6-triphenylpyridin-1-ium-1-yl)propane-1,3-diol perchlorate CAS Name: 2-(2,4,6-triphenyl-1-pyridin-1-iumyl)propane-1,3-diol perchlorate IUPAC Name: 2-(2,4,6-triphenylpyridin-1-ium-1-yl)propane-1,3-diol perchlorate Traditional Name: 2-(2,4,6-triphenylpyridin-1-ium-1-yl)propane-1,3-diol perchlorate Formula: C26H24ClNO6 MolecularWeight: 481.92486

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=[N+](C(=C2)C3=CC=CC=C3)C(CO)CO)C4=CC=CC=C4.[O-]Cl(=O)(=O)=O

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=[N+](C(=C2)C3=CC=CC=C3)C(CO)CO)C4=CC=CC=C4.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C26H24NO2.ClHO4/c28-18-24(19-29)27-25(21-12-6-2-7-13-21)16-23(20-10-4-1-5-11-20)17-26(27)22-14-8-3-9-15-22;2-1(3,4)5/h1-17,24,28-29H,18-19H2;(H,2,3,4,5)/q+1;/p-1