[2-[(3-fluorophenyl)amino]-2-oxidanylidene-ethyl]-[(2S)-3-methylbutan-2-yl]azanium

Systemtic Name: [2-[(3-fluorophenyl)amino]-2-oxidanylidene-ethyl]-[(2S)-3-methylbutan-2-yl]azanium Openeye Name: [(1S)-1,2-dimethylpropyl]-[2-(3-fluoroanilino)-2-oxo-ethyl]ammonium CAS Name: [2-(3-fluoroanilino)-2-oxoethyl]-[(2S)-3-methylbutan-2-yl]ammonium IUPAC Name: [2-(3-fluoroanilino)-2-oxoethyl]-[(2S)-3-methylbutan-2-yl]azanium Traditional Name: [(1S)-1,2-dimethylpropyl]-[2-(3-fluoroanilino)-2-keto-ethyl]ammonium Formula: C13H20FN2O+ MolecularWeight: 239.309103

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C)[NH2+]CC(=O)NC1=CC(=CC=C1)F

Isomeric SMILES

C[C@@H](C(C)C)[NH2+]CC(=O)NC1=CC(=CC=C1)F

InChI

InChI=1S/C13H19FN2O/c1-9(2)10(3)15-8-13(17)16-12-6-4-5-11(14)7-12/h4-7,9-10,15H,8H2,1-3H3,(H,16,17)/p+1/t10-/m0/s1