2-[5-(6-bromanyl-1,3-benzodioxol-5-yl)-1,2,3,4-tetrazol-2-yl]-N-tert-butyl-ethanamide

Systemtic Name: 2-[5-(6-bromanyl-1,3-benzodioxol-5-yl)-1,2,3,4-tetrazol-2-yl]-N-tert-butyl-ethanamide Openeye Name: 2-[5-(6-bromo-1,3-benzodioxol-5-yl)tetrazol-2-yl]-N-tert-butyl-acetamide CAS Name: 2-[5-(6-bromo-1,3-benzodioxol-5-yl)-2-tetrazolyl]-N-tert-butylacetamide IUPAC Name: 2-[5-(6-bromo-1,3-benzodioxol-5-yl)tetrazol-2-yl]-N-tert-butylacetamide Traditional Name: 2-[5-(6-bromo-1,3-benzodioxol-5-yl)tetrazol-2-yl]-N-tert-butyl-acetamide Formula: C14H16BrN5O3 MolecularWeight: 382.21254

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)CN1N=C(N=N1)C2=CC3=C(C=C2Br)OCO3

Isomeric SMILES

CC(C)(C)NC(=O)CN1N=C(N=N1)C2=CC3=C(C=C2Br)OCO3

InChI

InChI=1S/C14H16BrN5O3/c1-14(2,3)16-12(21)6-20-18-13(17-19-20)8-4-10-11(5-9(8)15)23-7-22-10/h4-5H,6-7H2,1-3H3,(H,16,21)