[(1S)-1-[3,4-bis(fluoranyl)phenyl]-2-ethyl-butyl]azanium

Systemtic Name: [(1S)-1-[3,4-bis(fluoranyl)phenyl]-2-ethyl-butyl]azanium Openeye Name: [(1S)-1-(3,4-difluorophenyl)-2-ethyl-butyl]ammonium CAS Name: [(1S)-1-(3,4-difluorophenyl)-2-ethylbutyl]ammonium IUPAC Name: [(1S)-1-(3,4-difluorophenyl)-2-ethylbutyl]azanium Traditional Name: [(1S)-1-(3,4-difluorophenyl)-2-ethyl-butyl]ammonium Formula: C12H18F2N+ MolecularWeight: 214.274826

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C(C1=CC(=C(C=C1)F)F)[NH3+]

Isomeric SMILES

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

InChI

InChI=1S/C12H17F2N/c1-3-8(4-2)12(15)9-5-6-10(13)11(14)7-9/h5-8,12H,3-4,15H2,1-2H3/p+1/t12-/m0/s1