[(2S)-4-(2-chloranyl-4-fluoranyl-phenoxy)-2-(diethylamino)butyl]azanium

Systemtic Name: [(2S)-4-(2-chloranyl-4-fluoranyl-phenoxy)-2-(diethylamino)butyl]azanium Openeye Name: [(2S)-4-(2-chloro-4-fluoro-phenoxy)-2-(diethylamino)butyl]ammonium CAS Name: [(2S)-4-(2-chloro-4-fluorophenoxy)-2-(diethylamino)butyl]ammonium IUPAC Name: [(2S)-4-(2-chloro-4-fluorophenoxy)-2-(diethylamino)butyl]azanium Traditional Name: [(2S)-4-(2-chloro-4-fluoro-phenoxy)-2-(diethylamino)butyl]ammonium Formula: C14H23ClFN2O+ MolecularWeight: 289.796623

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(CCOC1=C(C=C(C=C1)F)Cl)C[NH3+]

Isomeric SMILES

CCN(CC)[C@@H](CCOC1=C(C=C(C=C1)F)Cl)C[NH3+]

InChI

InChI=1S/C14H22ClFN2O/c1-3-18(4-2)12(10-17)7-8-19-14-6-5-11(16)9-13(14)15/h5-6,9,12H,3-4,7-8,10,17H2,1-2H3/p+1/t12-/m0/s1