2-bromanyl-5-(1-tert-butyl-3,5,8-trioxabicyclo[2.2.2]octan-4-yl)-4-diazonio-phenolate

Systemtic Name: 2-bromanyl-5-(1-tert-butyl-3,5,8-trioxabicyclo[2.2.2]octan-4-yl)-4-diazonio-phenolate Openeye Name: 2-bromo-5-(1-tert-butyl-3,5,8-trioxabicyclo[2.2.2]octan-4-yl)-4-diazonio-phenolate CAS Name: 2-bromo-5-(1-tert-butyl-3,5,8-trioxabicyclo[2.2.2]octan-4-yl)-4-diazoniophenolate IUPAC Name: 2-bromo-5-(1-tert-butyl-3,5,8-trioxabicyclo[2.2.2]octan-4-yl)-4-diazoniophenolate Traditional Name: 2-bromo-5-(1-tert-butyl-3,5,8-trioxabicyclo[2.2.2]octan-4-yl)-4-diazonio-phenolate Formula: C15H17BrN2O4 MolecularWeight: 369.21048

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C12COC(OC1)(OC2)C3=CC(=C(C=C3[N+]#N)Br)[O-]

Isomeric SMILES

CC(C)(C)C12COC(OC1)(OC2)C3=CC(=C(C=C3[N+]#N)Br)[O-]

InChI

InChI=1S/C15H17BrN2O4/c1-13(2,3)14-6-20-15(21-7-14,22-8-14)9-4-12(19)10(16)5-11(9)18-17/h4-5H,6-8H2,1-3H3