4-[(1,1-dimethyl-1,2,4-triazol-1-ium-3-yl)diazenyl]-N-methyl-N-(phenylmethyl)aniline

Systemtic Name: 4-[(1,1-dimethyl-1,2,4-triazol-1-ium-3-yl)diazenyl]-N-methyl-N-(phenylmethyl)aniline Openeye Name: N-benzyl-4-[(1,1-dimethyl-1,2,4-triazol-1-ium-3-yl)azo]-N-methyl-aniline CAS Name: 4-[(1,1-dimethyl-1,2,4-triazol-1-ium-3-yl)azo]-N-methyl-N-(phenylmethyl)aniline IUPAC Name: N-benzyl-4-[(1,1-dimethyl-1,2,4-triazol-1-ium-3-yl)diazenyl]-N-methylaniline Traditional Name: benzyl-[4-[(1,1-dimethyl-1,2,4-triazol-1-ium-3-yl)azo]phenyl]-methyl-amine Formula: C18H21N6+ MolecularWeight: 321.39954

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1)C2=CC=C(C=C2)N=NC3=N[N+](C=N3)(C)C

Isomeric SMILES

CN(CC1=CC=CC=C1)C2=CC=C(C=C2)N=NC3=N[N+](C=N3)(C)C

InChI

InChI=1S/C18H21N6/c1-23(13-15-7-5-4-6-8-15)17-11-9-16(10-12-17)20-21-18-19-14-24(2,3)22-18/h4-12,14H,13H2,1-3H3/q+1