1,3,5-triphenyl-4-(1-phenylethyl)-1,2,4-triazol-4-ium perchlorate

Systemtic Name: 1,3,5-triphenyl-4-(1-phenylethyl)-1,2,4-triazol-4-ium perchlorate Openeye Name: 1,3,5-triphenyl-4-(1-phenylethyl)-1,2,4-triazol-4-ium perchlorate CAS Name: 1,3,5-triphenyl-4-(1-phenylethyl)-1,2,4-triazol-4-ium perchlorate IUPAC Name: 1,3,5-triphenyl-4-(1-phenylethyl)-1,2,4-triazol-4-ium perchlorate Traditional Name: 1,3,5-triphenyl-4-(1-phenylethyl)-1,2,4-triazol-4-ium perchlorate Formula: C28H24ClN3O4 MolecularWeight: 501.96086

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)[N+]2=C(N(N=C2C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CC(C1=CC=CC=C1)[N+]2=C(N(N=C2C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C28H24N3.ClHO4/c1-22(23-14-6-2-7-15-23)30-27(24-16-8-3-9-17-24)29-31(26-20-12-5-13-21-26)28(30)25-18-10-4-11-19-25;2-1(3,4)5/h2-22H,1H3;(H,2,3,4,5)/q+1;/p-1