2,5-bis[(2-methylpropan-2-yl)oxy]-4-morpholin-4-yl-benzenediazonium; tris(fluoranyl)methanesulfonate

Systemtic Name: 2,5-bis[(2-methylpropan-2-yl)oxy]-4-morpholin-4-yl-benzenediazonium; tris(fluoranyl)methanesulfonate Openeye Name: 2,5-ditert-butoxy-4-morpholino-benzenediazonium; trifluoromethanesulfonate CAS Name: 2,5-bis[(2-methylpropan-2-yl)oxy]-4-(4-morpholinyl)benzenediazonium; trifluoromethanesulfonate IUPAC Name: 2,5-bis[(2-methylpropan-2-yl)oxy]-4-morpholin-4-ylbenzenediazonium; trifluoromethanesulfonate Traditional Name: 2,5-ditert-butoxy-4-morpholino-benzenediazonium triflate Formula: C19H28F3N3O6S MolecularWeight: 483.50233

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC1=CC(=C(C=C1[N+]#N)OC(C)(C)C)N2CCOCC2.C(F)(F)(F)S(=O)(=O)[O-]

Isomeric SMILES

CC(C)(C)OC1=CC(=C(C=C1[N+]#N)OC(C)(C)C)N2CCOCC2.C(F)(F)(F)S(=O)(=O)[O-]

InChI

InChI=1S/C18H28N3O3.CHF3O3S/c1-17(2,3)23-15-12-14(21-7-9-22-10-8-21)16(11-13(15)20-19)24-18(4,5)6;2-1(3,4)8(5,6)7/h11-12H,7-10H2,1-6H3;(H,5,6,7)/q+1;/p-1