2-chloranyl-6-ethoxycarbonyl-8-ethyl-5-oxidanylidene-1,8-naphthyridine-3-diazonium tetrafluoroborate

Systemtic Name: 2-chloranyl-6-ethoxycarbonyl-8-ethyl-5-oxidanylidene-1,8-naphthyridine-3-diazonium tetrafluoroborate Openeye Name: 2-chloro-6-ethoxycarbonyl-8-ethyl-5-oxo-1,8-naphthyridine-3-diazonium tetrafluoroborate CAS Name: 2-chloro-6-ethoxycarbonyl-8-ethyl-5-oxo-1,8-naphthyridine-3-diazonium tetrafluoroborate IUPAC Name: 2-chloro-6-ethoxycarbonyl-8-ethyl-5-oxo-1,8-naphthyridine-3-diazonium tetrafluoroborate Traditional Name: 6-carbethoxy-2-chloro-8-ethyl-5-keto-1,8-naphthyridine-3-diazonium tetrafluoroborate Formula: C13H12BClF4N4O3 MolecularWeight: 394.516993

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Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.CCN1C=C(C(=O)C2=CC(=C(N=C21)Cl)[N+]#N)C(=O)OCC

Isomeric SMILES

[B-](F)(F)(F)F.CCN1C=C(C(=O)C2=CC(=C(N=C21)Cl)[N+]#N)C(=O)OCC

InChI

InChI=1S/C13H12ClN4O3.BF4/c1-3-18-6-8(13(20)21-4-2)10(19)7-5-9(17-15)11(14)16-12(7)18;2-1(3,4)5/h5-6H,3-4H2,1-2H3;/q+1;-1