1,2,3,4-tetraphenylpyridin-1-ium ethanoate

Systemtic Name: 1,2,3,4-tetraphenylpyridin-1-ium ethanoate Openeye Name: 1,2,3,4-tetraphenylpyridin-1-ium acetate CAS Name: 1,2,3,4-tetraphenylpyridin-1-ium acetate IUPAC Name: 1,2,3,4-tetraphenylpyridin-1-ium acetate Traditional Name: 1,2,3,4-tetraphenylpyridin-1-ium acetate Formula: C31H25NO2 MolecularWeight: 443.5357

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)[O-].C1=CC=C(C=C1)C2=C(C(=[N+](C=C2)C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC(=O)[O-].C1=CC=C(C=C1)C2=C(C(=[N+](C=C2)C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C29H22N.C2H4O2/c1-5-13-23(14-6-1)27-21-22-30(26-19-11-4-12-20-26)29(25-17-9-3-10-18-25)28(27)24-15-7-2-8-16-24;1-2(3)4/h1-22H;1H3,(H,3,4)/q+1;/p-1