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

Systemtic Name: cyano-[4-[[1-(4-fluorophenyl)ethylamino]carbamoyl]pyridin-1-ium-1-yl]boron Openeye Name: cyano-[4-[[1-(4-fluorophenyl)ethylamino]carbamoyl]pyridin-1-ium-1-yl]boron CAS Name: cyano-[4-[[1-(4-fluorophenyl)ethylhydrazo]-oxomethyl]-1-pyridin-1-iumyl]boron IUPAC Name: cyano-[4-[[1-(4-fluorophenyl)ethylamino]carbamoyl]pyridin-1-ium-1-yl]boron Traditional Name: cyano-[4-[[1-(4-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=C(C=C2)F

Isomeric SMILES

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

InChI

InChI=1S/C15H13BFN4O/c1-11(12-2-4-14(17)5-3-12)19-20-15(22)13-6-8-21(9-7-13)16-10-18/h2-9,11,22H,1H3/p+1