1,3,4-triphenyl-1,2,4-triazol-4-ium perchlorate

Systemtic Name: 1,3,4-triphenyl-1,2,4-triazol-4-ium perchlorate Openeye Name: 1,3,4-triphenyl-1,2,4-triazol-4-ium perchlorate CAS Name: 1,3,4-triphenyl-1,2,4-triazol-4-ium perchlorate IUPAC Name: 1,3,4-triphenyl-1,2,4-triazol-4-ium perchlorate Traditional Name: 1,3,4-triphenyl-1,2,4-triazol-4-ium perchlorate Formula: C20H16ClN3O4 MolecularWeight: 397.81174

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(C=[N+]2C3=CC=CC=C3)C4=CC=CC=C4.[O-]Cl(=O)(=O)=O

Isomeric SMILES

C1=CC=C(C=C1)C2=NN(C=[N+]2C3=CC=CC=C3)C4=CC=CC=C4.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C20H16N3.ClHO4/c1-4-10-17(11-5-1)20-21-23(19-14-8-3-9-15-19)16-22(20)18-12-6-2-7-13-18;2-1(3,4)5/h1-16H;(H,2,3,4,5)/q+1;/p-1