4-[5-(4-tert-butylphenoxy)-1,2,3,4-tetrazol-1-yl]benzoate

Systemtic Name: 4-[5-(4-tert-butylphenoxy)-1,2,3,4-tetrazol-1-yl]benzoate Openeye Name: 4-[5-(4-tert-butylphenoxy)tetrazol-1-yl]benzoate CAS Name: 4-[5-(4-tert-butylphenoxy)-1-tetrazolyl]benzoate IUPAC Name: 4-[5-(4-tert-butylphenoxy)tetrazol-1-yl]benzoate Traditional Name: 4-[5-(4-tert-butylphenoxy)tetrazol-1-yl]benzoate Formula: C18H17N4O3- MolecularWeight: 337.35258

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)OC2=NN=NN2C3=CC=C(C=C3)C(=O)[O-]

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)OC2=NN=NN2C3=CC=C(C=C3)C(=O)[O-]

InChI

InChI=1S/C18H18N4O3/c1-18(2,3)13-6-10-15(11-7-13)25-17-19-20-21-22(17)14-8-4-12(5-9-14)16(23)24/h4-11H,1-3H3,(H,23,24)/p-1