[(2S)-1-(4-fluoranyl-3-methyl-phenyl)-4-methyl-1-oxidanylidene-pentan-2-yl]azanium

Systemtic Name: [(2S)-1-(4-fluoranyl-3-methyl-phenyl)-4-methyl-1-oxidanylidene-pentan-2-yl]azanium Openeye Name: [(1S)-1-(4-fluoro-3-methyl-benzoyl)-3-methyl-butyl]ammonium CAS Name: [(2S)-1-(4-fluoro-3-methylphenyl)-4-methyl-1-oxopentan-2-yl]ammonium IUPAC Name: [(2S)-1-(4-fluoro-3-methylphenyl)-4-methyl-1-oxopentan-2-yl]azanium Traditional Name: [(1S)-1-(4-fluoro-3-methyl-benzoyl)-3-methyl-butyl]ammonium Formula: C13H19FNO+ MolecularWeight: 224.294463

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)C(CC(C)C)[NH3+])F

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)[C@H](CC(C)C)[NH3+])F

InChI

InChI=1S/C13H18FNO/c1-8(2)6-12(15)13(16)10-4-5-11(14)9(3)7-10/h4-5,7-8,12H,6,15H2,1-3H3/p+1/t12-/m0/s1