1,4-bis(2,6-dimethylphenyl)-3-phenyl-1,2,4-triazol-4-ium perchlorate

Systemtic Name: 1,4-bis(2,6-dimethylphenyl)-3-phenyl-1,2,4-triazol-4-ium perchlorate Openeye Name: 1,4-bis(2,6-dimethylphenyl)-3-phenyl-1,2,4-triazol-4-ium perchlorate CAS Name: 1,4-bis(2,6-dimethylphenyl)-3-phenyl-1,2,4-triazol-4-ium perchlorate IUPAC Name: 1,4-bis(2,6-dimethylphenyl)-3-phenyl-1,2,4-triazol-4-ium perchlorate Traditional Name: 1,4-bis(2,6-dimethylphenyl)-3-phenyl-1,2,4-triazol-4-ium perchlorate Formula: C24H24ClN3O4 MolecularWeight: 453.91806

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)N2C=[N+](C(=N2)C3=CC=CC=C3)C4=C(C=CC=C4C)C.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CC1=C(C(=CC=C1)C)N2C=[N+](C(=N2)C3=CC=CC=C3)C4=C(C=CC=C4C)C.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C24H24N3.ClHO4/c1-17-10-8-11-18(2)22(17)26-16-27(23-19(3)12-9-13-20(23)4)25-24(26)21-14-6-5-7-15-21;2-1(3,4)5/h5-16H,1-4H3;(H,2,3,4,5)/q+1;/p-1