1,3,5-triphenyl-4-propan-2-yl-1,2,4-triazol-4-ium perchlorate

Systemtic Name: 1,3,5-triphenyl-4-propan-2-yl-1,2,4-triazol-4-ium perchlorate Openeye Name: 4-isopropyl-1,3,5-triphenyl-1,2,4-triazol-4-ium perchlorate CAS Name: 1,3,5-triphenyl-4-propan-2-yl-1,2,4-triazol-4-ium perchlorate IUPAC Name: 1,3,5-triphenyl-4-propan-2-yl-1,2,4-triazol-4-ium perchlorate Traditional Name: 4-isopropyl-1,3,5-triphenyl-1,2,4-triazol-4-ium perchlorate Formula: C23H22ClN3O4 MolecularWeight: 439.89148

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[N+]1=C(N(N=C1C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CC(C)[N+]1=C(N(N=C1C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C23H22N3.ClHO4/c1-18(2)25-22(19-12-6-3-7-13-19)24-26(21-16-10-5-11-17-21)23(25)20-14-8-4-9-15-20;2-1(3,4)5/h3-18H,1-2H3;(H,2,3,4,5)/q+1;/p-1