1-butyl-2,3,4,5-tetraphenyl-4H-imidazol-1-ium-5-ol perchlorate

Systemtic Name: 1-butyl-2,3,4,5-tetraphenyl-4H-imidazol-1-ium-5-ol perchlorate Openeye Name: 1-butyl-2,3,4,5-tetraphenyl-4H-imidazol-1-ium-5-ol perchlorate CAS Name: 1-butyl-2,3,4,5-tetraphenyl-4H-imidazol-1-ium-5-ol perchlorate IUPAC Name: 1-butyl-2,3,4,5-tetraphenyl-4H-imidazol-1-ium-5-ol perchlorate Traditional Name: 3-butyl-1,2,4,5-tetraphenyl-2-imidazolin-3-ium-4-ol perchlorate Formula: C31H31ClN2O5 MolecularWeight: 547.04124

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[N+]1=C(N(C(C1(C2=CC=CC=C2)O)C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CCCC[N+]1=C(N(C(C1(C2=CC=CC=C2)O)C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C31H31N2O.ClHO4/c1-2-3-24-32-30(26-18-10-5-11-19-26)33(28-22-14-7-15-23-28)29(25-16-8-4-9-17-25)31(32,34)27-20-12-6-13-21-27;2-1(3,4)5/h4-23,29,34H,2-3,24H2,1H3;(H,2,3,4,5)/q+1;/p-1