5-hexyl-1,2-diphenyl-1,2,3,4-tetrazol-1-ium bromide

Systemtic Name: 5-hexyl-1,2-diphenyl-1,2,3,4-tetrazol-1-ium bromide Openeye Name: 5-hexyl-1,2-diphenyl-tetrazol-1-ium bromide CAS Name: 5-hexyl-1,2-diphenyltetrazol-1-ium bromide IUPAC Name: 5-hexyl-1,2-diphenyltetrazol-1-ium bromide Traditional Name: 5-hexyl-1,2-diphenyl-tetrazol-1-ium bromide Formula: C19H23BrN4 MolecularWeight: 387.31672

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=[N+](N(N=N1)C2=CC=CC=C2)C3=CC=CC=C3.[Br-]

Isomeric SMILES

CCCCCCC1=[N+](N(N=N1)C2=CC=CC=C2)C3=CC=CC=C3.[Br-]

InChI

InChI=1S/C19H23N4.BrH/c1-2-3-4-11-16-19-20-21-23(18-14-9-6-10-15-18)22(19)17-12-7-5-8-13-17;/h5-10,12-15H,2-4,11,16H2,1H3;1H/q+1;/p-1