5-tert-butyl-2,3-bis(4-nitrophenyl)-1,2,3,4-tetrazol-2-ium chloride

Systemtic Name: 5-tert-butyl-2,3-bis(4-nitrophenyl)-1,2,3,4-tetrazol-2-ium chloride Openeye Name: 5-tert-butyl-2,3-bis(4-nitrophenyl)tetrazol-2-ium chloride CAS Name: 5-tert-butyl-2,3-bis(4-nitrophenyl)tetrazol-2-ium chloride IUPAC Name: 5-tert-butyl-2,3-bis(4-nitrophenyl)tetrazol-2-ium chloride Traditional Name: 5-tert-butyl-2,3-bis(4-nitrophenyl)tetrazol-2-ium chloride Formula: C17H17ClN6O4 MolecularWeight: 404.80768

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN([N+](=N1)C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=C(C=C3)[N+](=O)[O-].[Cl-]

Isomeric SMILES

CC(C)(C)C1=NN([N+](=N1)C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=C(C=C3)[N+](=O)[O-].[Cl-]

InChI

InChI=1S/C17H17N6O4.ClH/c1-17(2,3)16-18-20(12-4-8-14(9-5-12)22(24)25)21(19-16)13-6-10-15(11-7-13)23(26)27;/h4-11H,1-3H3;1H/q+1;/p-1