1-methyl-N,3,5-triphenyl-1,2,4-triazol-4-ium-4-amine chloride

Systemtic Name: 1-methyl-N,3,5-triphenyl-1,2,4-triazol-4-ium-4-amine chloride Openeye Name: 1-methyl-N,3,5-triphenyl-1,2,4-triazol-4-ium-4-amine chloride CAS Name: 1-methyl-N,3,5-triphenyl-1,2,4-triazol-4-ium-4-amine chloride IUPAC Name: 1-methyl-N,3,5-triphenyl-1,2,4-triazol-4-ium-4-amine chloride Traditional Name: (1-methyl-3,5-diphenyl-1,2,4-triazol-4-ium-4-yl)-phenyl-amine chloride Formula: C21H19ClN4 MolecularWeight: 362.85536

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=[N+](C(=N1)C2=CC=CC=C2)NC3=CC=CC=C3)C4=CC=CC=C4.[Cl-]

Isomeric SMILES

CN1C(=[N+](C(=N1)C2=CC=CC=C2)NC3=CC=CC=C3)C4=CC=CC=C4.[Cl-]

InChI

InChI=1S/C21H19N4.ClH/c1-24-21(18-13-7-3-8-14-18)25(22-19-15-9-4-10-16-19)20(23-24)17-11-5-2-6-12-17;/h2-16,22H,1H3;1H/q+1;/p-1