1-(4-tert-butylphenyl)-2H-1,2,3,4-tetrazol-5-one

Systemtic Name: 1-(4-tert-butylphenyl)-2H-1,2,3,4-tetrazol-5-one Openeye Name: 1-(4-tert-butylphenyl)-2H-tetrazol-5-one CAS Name: 1-(4-tert-butylphenyl)-2H-tetrazol-5-one IUPAC Name: 1-(4-tert-butylphenyl)-2H-tetrazol-5-one Traditional Name: 1-(4-tert-butylphenyl)-2H-tetrazol-5-one Formula: C11H14N4O MolecularWeight: 218.25506

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)N2C(=O)N=NN2

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)N2C(=O)N=NN2

InChI

InChI=1S/C11H14N4O/c1-11(2,3)8-4-6-9(7-5-8)15-10(16)12-13-14-15/h4-7H,1-3H3,(H,12,14,16)