2-(7-bromanyl-8-methoxy-quinolin-5-yl)-4-methoxy-benzenediazonium; hydrogen sulfate

Systemtic Name: 2-(7-bromanyl-8-methoxy-quinolin-5-yl)-4-methoxy-benzenediazonium; hydrogen sulfate Openeye Name: 2-(7-bromo-8-methoxy-5-quinolyl)-4-methoxy-benzenediazonium; hydrogen sulfate CAS Name: 2-(7-bromo-8-methoxy-5-quinolinyl)-4-methoxybenzenediazonium; hydrogen sulfate IUPAC Name: 2-(7-bromo-8-methoxyquinolin-5-yl)-4-methoxybenzenediazonium; hydrogen sulfate Traditional Name: 2-(7-bromo-8-methoxy-5-quinolyl)-4-methoxy-benzenediazonium bisulfate Formula: C17H14BrN3O6S MolecularWeight: 468.27856

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)[N+]#N)C2=CC(=C(C3=C2C=CC=N3)OC)Br.OS(=O)(=O)[O-]

Isomeric SMILES

COC1=CC(=C(C=C1)[N+]#N)C2=CC(=C(C3=C2C=CC=N3)OC)Br.OS(=O)(=O)[O-]

InChI

InChI=1S/C17H13BrN3O2.H2O4S/c1-22-10-5-6-15(21-19)13(8-10)12-9-14(18)17(23-2)16-11(12)4-3-7-20-16;1-5(2,3)4/h3-9H,1-2H3;(H2,1,2,3,4)/q+1;/p-1