(4-aminocarbonyl-2-fluoranyl-phenyl)methyl-[(2S)-3-methylbutan-2-yl]azanium

Systemtic Name: (4-aminocarbonyl-2-fluoranyl-phenyl)methyl-[(2S)-3-methylbutan-2-yl]azanium Openeye Name: (4-carbamoyl-2-fluoro-phenyl)methyl-[(1S)-1,2-dimethylpropyl]ammonium CAS Name: (4-carbamoyl-2-fluorophenyl)methyl-[(2S)-3-methylbutan-2-yl]ammonium IUPAC Name: (4-carbamoyl-2-fluorophenyl)methyl-[(2S)-3-methylbutan-2-yl]azanium Traditional Name: (4-carbamoyl-2-fluoro-benzyl)-[(1S)-1,2-dimethylpropyl]ammonium Formula: C13H20FN2O+ MolecularWeight: 239.309103

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H19FN2O/c1-8(2)9(3)16-7-11-5-4-10(13(15)17)6-12(11)14/h4-6,8-9,16H,7H2,1-3H3,(H2,15,17)/p+1/t9-/m0/s1