2-(7-bromanyl-8-methoxy-quinolin-5-yl)benzenediazonium; hydrogen sulfate

Systemtic Name: 2-(7-bromanyl-8-methoxy-quinolin-5-yl)benzenediazonium; hydrogen sulfate Openeye Name: 2-(7-bromo-8-methoxy-5-quinolyl)benzenediazonium; hydrogen sulfate CAS Name: 2-(7-bromo-8-methoxy-5-quinolinyl)benzenediazonium; hydrogen sulfate IUPAC Name: 2-(7-bromo-8-methoxyquinolin-5-yl)benzenediazonium; hydrogen sulfate Traditional Name: 2-(7-bromo-8-methoxy-5-quinolyl)benzenediazonium bisulfate Formula: C16H12BrN3O5S MolecularWeight: 438.25258

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C2=C1N=CC=C2)C3=CC=CC=C3[N+]#N)Br.OS(=O)(=O)[O-]

Isomeric SMILES

COC1=C(C=C(C2=C1N=CC=C2)C3=CC=CC=C3[N+]#N)Br.OS(=O)(=O)[O-]

InChI

InChI=1S/C16H11BrN3O.H2O4S/c1-21-16-13(17)9-12(11-6-4-8-19-15(11)16)10-5-2-3-7-14(10)20-18;1-5(2,3)4/h2-9H,1H3;(H2,1,2,3,4)/q+1;/p-1