2-(4-tert-butyl-1,2,3,4-tetrazol-4-ium-1-yl)benzoic acid perchlorate

Systemtic Name: 2-(4-tert-butyl-1,2,3,4-tetrazol-4-ium-1-yl)benzoic acid perchlorate Openeye Name: 2-(4-tert-butyltetrazol-4-ium-1-yl)benzoic acid perchlorate CAS Name: 2-(4-tert-butyl-1-tetrazol-4-iumyl)benzoic acid perchlorate IUPAC Name: 2-(4-tert-butyltetrazol-4-ium-1-yl)benzoic acid perchlorate Traditional Name: 2-(4-tert-butyltetrazol-4-ium-1-yl)benzoic acid perchlorate Formula: C12H15ClN4O6 MolecularWeight: 346.7237

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)[N+]1=CN(N=N1)C2=CC=CC=C2C(=O)O.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CC(C)(C)[N+]1=CN(N=N1)C2=CC=CC=C2C(=O)O.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C12H14N4O2.ClHO4/c1-12(2,3)16-8-15(13-14-16)10-7-5-4-6-9(10)11(17)18;2-1(3,4)5/h4-8H,1-3H3;(H,2,3,4,5)