[(2S)-1-(tert-butylamino)-1-oxidanylidene-propan-2-yl]-[(4-fluorophenyl)methyl]azanium

Systemtic Name: [(2S)-1-(tert-butylamino)-1-oxidanylidene-propan-2-yl]-[(4-fluorophenyl)methyl]azanium Openeye Name: [(1S)-2-(tert-butylamino)-1-methyl-2-oxo-ethyl]-[(4-fluorophenyl)methyl]ammonium CAS Name: [(2S)-1-(tert-butylamino)-1-oxopropan-2-yl]-[(4-fluorophenyl)methyl]ammonium IUPAC Name: [(2S)-1-(tert-butylamino)-1-oxopropan-2-yl]-[(4-fluorophenyl)methyl]azanium Traditional Name: [(1S)-2-(tert-butylamino)-2-keto-1-methyl-ethyl]-(4-fluorobenzyl)ammonium Formula: C14H22FN2O+ MolecularWeight: 253.335683

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H21FN2O/c1-10(13(18)17-14(2,3)4)16-9-11-5-7-12(15)8-6-11/h5-8,10,16H,9H2,1-4H3,(H,17,18)/p+1/t10-/m0/s1