[2-(cyanomethylamino)-2-oxidanylidene-ethyl]-[2-(4-fluorophenyl)ethyl]azanium

Systemtic Name: [2-(cyanomethylamino)-2-oxidanylidene-ethyl]-[2-(4-fluorophenyl)ethyl]azanium Openeye Name: [2-(cyanomethylamino)-2-oxo-ethyl]-[2-(4-fluorophenyl)ethyl]ammonium CAS Name: [2-(cyanomethylamino)-2-oxoethyl]-[2-(4-fluorophenyl)ethyl]ammonium IUPAC Name: [2-(cyanomethylamino)-2-oxoethyl]-[2-(4-fluorophenyl)ethyl]azanium Traditional Name: [2-(cyanomethylamino)-2-keto-ethyl]-[2-(4-fluorophenyl)ethyl]ammonium Formula: C12H15FN3O+ MolecularWeight: 236.265403

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC[NH2+]CC(=O)NCC#N)F

Isomeric SMILES

C1=CC(=CC=C1CC[NH2+]CC(=O)NCC#N)F

InChI

InChI=1S/C12H14FN3O/c13-11-3-1-10(2-4-11)5-7-15-9-12(17)16-8-6-14/h1-4,15H,5,7-9H2,(H,16,17)/p+1