(4-aminocarbonyl-2-fluoranyl-phenyl)methyl-(2-methylbutan-2-yl)azanium

Systemtic Name: (4-aminocarbonyl-2-fluoranyl-phenyl)methyl-(2-methylbutan-2-yl)azanium Openeye Name: (4-carbamoyl-2-fluoro-phenyl)methyl-(1,1-dimethylpropyl)ammonium CAS Name: (4-carbamoyl-2-fluorophenyl)methyl-(2-methylbutan-2-yl)ammonium IUPAC Name: (4-carbamoyl-2-fluorophenyl)methyl-(2-methylbutan-2-yl)azanium Traditional Name: tert-amyl-(4-carbamoyl-2-fluoro-benzyl)ammonium Formula: C13H20FN2O+ MolecularWeight: 239.309103

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)[NH2+]CC1=C(C=C(C=C1)C(=O)N)F

Isomeric SMILES

CCC(C)(C)[NH2+]CC1=C(C=C(C=C1)C(=O)N)F

InChI

InChI=1S/C13H19FN2O/c1-4-13(2,3)16-8-10-6-5-9(12(15)17)7-11(10)14/h5-7,16H,4,8H2,1-3H3,(H2,15,17)/p+1