5-(2-fluorophenyl)-1-methyl-2-oxidanylidene-3H-1,4-benzodiazepine-7-diazonium tetrafluoroborate

Systemtic Name: 5-(2-fluorophenyl)-1-methyl-2-oxidanylidene-3H-1,4-benzodiazepine-7-diazonium tetrafluoroborate Openeye Name: 5-(2-fluorophenyl)-1-methyl-2-oxo-3H-1,4-benzodiazepine-7-diazonium tetrafluoroborate CAS Name: 5-(2-fluorophenyl)-1-methyl-2-oxo-3H-1,4-benzodiazepine-7-diazonium tetrafluoroborate IUPAC Name: 5-(2-fluorophenyl)-1-methyl-2-oxo-3H-1,4-benzodiazepine-7-diazonium tetrafluoroborate Traditional Name: 5-(2-fluorophenyl)-2-keto-1-methyl-3H-1,4-benzodiazepine-7-diazonium tetrafluoroborate Formula: C16H12BF5N4O MolecularWeight: 382.095696

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Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.CN1C(=O)CN=C(C2=C1C=CC(=C2)[N+]#N)C3=CC=CC=C3F

Isomeric SMILES

[B-](F)(F)(F)F.CN1C(=O)CN=C(C2=C1C=CC(=C2)[N+]#N)C3=CC=CC=C3F

InChI

InChI=1S/C16H12FN4O.BF4/c1-21-14-7-6-10(20-18)8-12(14)16(19-9-15(21)22)11-4-2-3-5-13(11)17;2-1(3,4)5/h2-8H,9H2,1H3;/q+1;-1