2-(1-methylpyridin-1-ium-4-yl)-4,5-diphenyl-1,3-oxazole perchlorate

Systemtic Name: 2-(1-methylpyridin-1-ium-4-yl)-4,5-diphenyl-1,3-oxazole perchlorate Openeye Name: 2-(1-methylpyridin-1-ium-4-yl)-4,5-diphenyl-oxazole perchlorate CAS Name: 2-(1-methyl-4-pyridin-1-iumyl)-4,5-diphenyloxazole perchlorate IUPAC Name: 2-(1-methylpyridin-1-ium-4-yl)-4,5-diphenyl-1,3-oxazole perchlorate Traditional Name: 2-(1-methylpyridin-1-ium-4-yl)-4,5-diphenyl-oxazole perchlorate Formula: C21H17ClN2O5 MolecularWeight: 412.82308

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC=C(C=C1)C2=NC(=C(O2)C3=CC=CC=C3)C4=CC=CC=C4.[O-]Cl(=O)(=O)=O

Isomeric SMILES

C[N+]1=CC=C(C=C1)C2=NC(=C(O2)C3=CC=CC=C3)C4=CC=CC=C4.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C21H17N2O.ClHO4/c1-23-14-12-18(13-15-23)21-22-19(16-8-4-2-5-9-16)20(24-21)17-10-6-3-7-11-17;2-1(3,4)5/h2-15H,1H3;(H,2,3,4,5)/q+1;/p-1