1-phenyl-N-[1-(phenylmethyl)-1,2,4-triazol-4-ium-4-yl]methanimine chloride

Systemtic Name: 1-phenyl-N-[1-(phenylmethyl)-1,2,4-triazol-4-ium-4-yl]methanimine chloride Openeye Name: N-(1-benzyl-1,2,4-triazol-4-ium-4-yl)-1-phenyl-methanimine chloride CAS Name: 1-phenyl-N-[1-(phenylmethyl)-1,2,4-triazol-4-ium-4-yl]methanimine chloride IUPAC Name: N-(1-benzyl-1,2,4-triazol-4-ium-4-yl)-1-phenylmethanimine chloride Traditional Name: (Z)-benzal-(1-benzyl-1,2,4-triazol-4-ium-4-yl)amine chloride Formula: C16H15ClN4 MolecularWeight: 298.7701

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=[N+](C=N2)N=CC3=CC=CC=C3.[Cl-]

Isomeric SMILES

C1=CC=C(C=C1)CN2C=[N+](C=N2)/N=C\C3=CC=CC=C3.[Cl-]

InChI

InChI=1S/C16H15N4.ClH/c1-3-7-15(8-4-1)11-17-20-13-18-19(14-20)12-16-9-5-2-6-10-16;/h1-11,13-14H,12H2;1H/q+1;/p-1/b17-11-;