cyano-[4-[[1-(2-fluorophenyl)ethylamino]carbamoyl]pyridin-1-ium-1-yl]boron

Systemtic Name: cyano-[4-[[1-(2-fluorophenyl)ethylamino]carbamoyl]pyridin-1-ium-1-yl]boron Openeye Name: cyano-[4-[[1-(2-fluorophenyl)ethylamino]carbamoyl]pyridin-1-ium-1-yl]boron CAS Name: cyano-[4-[[1-(2-fluorophenyl)ethylhydrazo]-oxomethyl]-1-pyridin-1-iumyl]boron IUPAC Name: cyano-[4-[[1-(2-fluorophenyl)ethylamino]carbamoyl]pyridin-1-ium-1-yl]boron Traditional Name: cyano-[4-[[1-(2-fluorophenyl)ethylamino]carbamoyl]pyridin-1-ium-1-yl]boron Formula: C15H14BFN4O+ MolecularWeight: 296.107263

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Descriptors Computed from Structure

Canonical SMILES:

[B](C#N)[N+]1=CC=C(C=C1)C(=O)NNC(C)C2=CC=CC=C2F

Isomeric SMILES

[B](C#N)[N+]1=CC=C(C=C1)C(=O)NNC(C)C2=CC=CC=C2F

InChI

InChI=1S/C15H14BFN4O/c1-11(13-4-2-3-5-14(13)17)19-20-15(22)12-6-8-21(9-7-12)16-10-18/h2-9,11,19H,1H3,(H,20,22)/q+1