1-[(4-bromophenyl)methyl]-4-methyl-3,5-diphenyl-1,2,4-triazol-4-ium

Systemtic Name: 1-[(4-bromophenyl)methyl]-4-methyl-3,5-diphenyl-1,2,4-triazol-4-ium Openeye Name: 1-[(4-bromophenyl)methyl]-4-methyl-3,5-diphenyl-1,2,4-triazol-4-ium CAS Name: 1-[(4-bromophenyl)methyl]-4-methyl-3,5-diphenyl-1,2,4-triazol-4-ium IUPAC Name: 1-[(4-bromophenyl)methyl]-4-methyl-3,5-diphenyl-1,2,4-triazol-4-ium Traditional Name: 1-(4-bromobenzyl)-4-methyl-3,5-diphenyl-1,2,4-triazol-4-ium Formula: C22H19BrN3+ MolecularWeight: 405.31036

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(N(N=C1C2=CC=CC=C2)CC3=CC=C(C=C3)Br)C4=CC=CC=C4

Isomeric SMILES

C[N+]1=C(N(N=C1C2=CC=CC=C2)CC3=CC=C(C=C3)Br)C4=CC=CC=C4

InChI

InChI=1S/C22H19BrN3/c1-25-21(18-8-4-2-5-9-18)24-26(16-17-12-14-20(23)15-13-17)22(25)19-10-6-3-7-11-19/h2-15H,16H2,1H3/q+1