4-(4-chloranylphenoxy)-2,5-diethoxy-benzenediazonium; tris(fluoranyl)methanesulfonate

Systemtic Name: 4-(4-chloranylphenoxy)-2,5-diethoxy-benzenediazonium; tris(fluoranyl)methanesulfonate Openeye Name: 4-(4-chlorophenoxy)-2,5-diethoxy-benzenediazonium; trifluoromethanesulfonate CAS Name: 4-(4-chlorophenoxy)-2,5-diethoxybenzenediazonium; trifluoromethanesulfonate IUPAC Name: 4-(4-chlorophenoxy)-2,5-diethoxybenzenediazonium; trifluoromethanesulfonate Traditional Name: 4-(4-chlorophenoxy)-2,5-diethoxy-benzenediazonium triflate Formula: C17H16ClF3N2O6S MolecularWeight: 468.83195

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1[N+]#N)OCC)OC2=CC=C(C=C2)Cl.C(F)(F)(F)S(=O)(=O)[O-]

Isomeric SMILES

CCOC1=CC(=C(C=C1[N+]#N)OCC)OC2=CC=C(C=C2)Cl.C(F)(F)(F)S(=O)(=O)[O-]

InChI

InChI=1S/C16H16ClN2O3.CHF3O3S/c1-3-20-14-10-16(15(21-4-2)9-13(14)19-18)22-12-7-5-11(17)6-8-12;2-1(3,4)8(5,6)7/h5-10H,3-4H2,1-2H3;(H,5,6,7)/q+1;/p-1