[3-acetyloxy-2-(2,4,6-triphenylpyridin-1-ium-1-yl)propyl] ethanoate perchlorate

Systemtic Name: [3-acetyloxy-2-(2,4,6-triphenylpyridin-1-ium-1-yl)propyl] ethanoate perchlorate Openeye Name: [3-acetoxy-2-(2,4,6-triphenylpyridin-1-ium-1-yl)propyl] acetate perchlorate CAS Name: acetic acid [3-acetyloxy-2-(2,4,6-triphenyl-1-pyridin-1-iumyl)propyl] ester perchlorate IUPAC Name: [3-acetyloxy-2-(2,4,6-triphenylpyridin-1-ium-1-yl)propyl] acetate perchlorate Traditional Name: acetic acid [3-acetoxy-2-(2,4,6-triphenylpyridin-1-ium-1-yl)propyl] ester perchlorate Formula: C30H28ClNO8 MolecularWeight: 565.99822

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC(COC(=O)C)[N+]1=C(C=C(C=C1C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CC(=O)OCC(COC(=O)C)[N+]1=C(C=C(C=C1C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C30H28NO4.ClHO4/c1-22(32)34-20-28(21-35-23(2)33)31-29(25-14-8-4-9-15-25)18-27(24-12-6-3-7-13-24)19-30(31)26-16-10-5-11-17-26;2-1(3,4)5/h3-19,28H,20-21H2,1-2H3;(H,2,3,4,5)/q+1;/p-1