3-tert-butyl-1,2,3,4-benzotetrazin-3-ium

Systemtic Name: 3-tert-butyl-1,2,3,4-benzotetrazin-3-ium Openeye Name: 3-tert-butyl-1,2,3,4-benzotetrazin-3-ium CAS Name: 3-tert-butyl-1,2,3,4-benzotetrazin-3-ium IUPAC Name: 3-tert-butyl-1,2,3,4-benzotetrazin-3-ium Traditional Name: 3-tert-butyl-1,2,3,4-benzotetrazin-3-ium Formula: C10H13N4+ MolecularWeight: 189.23702

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)[N+]1=NC2=CC=CC=C2N=N1

Isomeric SMILES

CC(C)(C)[N+]1=NC2=CC=CC=C2N=N1

InChI

InChI=1S/C10H13N4/c1-10(2,3)14-12-9-7-5-4-6-8(9)11-13-14/h4-7H,1-3H3/q+1