4-(3-bromanyl-2-oxidanylidene-1H-1,6-naphthyridin-5-yl)benzenediazonium; hydrogen sulfate

Systemtic Name: 4-(3-bromanyl-2-oxidanylidene-1H-1,6-naphthyridin-5-yl)benzenediazonium; hydrogen sulfate Openeye Name: 4-(3-bromo-2-oxo-1H-1,6-naphthyridin-5-yl)benzenediazonium; hydrogen sulfate CAS Name: 4-(3-bromo-2-oxo-1H-1,6-naphthyridin-5-yl)benzenediazonium; hydrogen sulfate IUPAC Name: 4-(3-bromo-2-oxo-1H-1,6-naphthyridin-5-yl)benzenediazonium; hydrogen sulfate Traditional Name: 4-(3-bromo-2-keto-1H-1,6-naphthyridin-5-yl)benzenediazonium bisulfate Formula: C14H9BrN4O5S MolecularWeight: 425.21406

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NC=CC3=C2C=C(C(=O)N3)Br)[N+]#N.OS(=O)(=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C2=NC=CC3=C2C=C(C(=O)N3)Br)[N+]#N.OS(=O)(=O)[O-]

InChI

InChI=1S/C14H7BrN4O.H2O4S/c15-11-7-10-12(18-14(11)20)5-6-17-13(10)8-1-3-9(19-16)4-2-8;1-5(2,3)4/h1-7H;(H2,1,2,3,4)