3-[[2-[(2-fluorophenyl)amino]-2-oxidanylidene-ethanoyl]amino]propyl-dimethyl-azanium

Systemtic Name: 3-[[2-[(2-fluorophenyl)amino]-2-oxidanylidene-ethanoyl]amino]propyl-dimethyl-azanium Openeye Name: 3-[[2-(2-fluoroanilino)-2-oxo-acetyl]amino]propyl-dimethyl-ammonium CAS Name: 3-[[2-(2-fluoroanilino)-1,2-dioxoethyl]amino]propyl-dimethylammonium IUPAC Name: 3-[[2-(2-fluoroanilino)-2-oxoacetyl]amino]propyl-dimethylazanium Traditional Name: 3-[[2-(2-fluoroanilino)-2-keto-acetyl]amino]propyl-dimethyl-ammonium Formula: C13H19FN3O2+ MolecularWeight: 268.307263

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCNC(=O)C(=O)NC1=CC=CC=C1F

Isomeric SMILES

C[NH+](C)CCCNC(=O)C(=O)NC1=CC=CC=C1F

InChI

InChI=1S/C13H18FN3O2/c1-17(2)9-5-8-15-12(18)13(19)16-11-7-4-3-6-10(11)14/h3-4,6-7H,5,8-9H2,1-2H3,(H,15,18)(H,16,19)/p+1