[(3S)-3-(4-fluoranyl-3-methyl-phenyl)-3-(4-fluoranylphenoxy)propyl]azanium

Systemtic Name: [(3S)-3-(4-fluoranyl-3-methyl-phenyl)-3-(4-fluoranylphenoxy)propyl]azanium Openeye Name: [(3S)-3-(4-fluoro-3-methyl-phenyl)-3-(4-fluorophenoxy)propyl]ammonium CAS Name: [(3S)-3-(4-fluoro-3-methylphenyl)-3-(4-fluorophenoxy)propyl]ammonium IUPAC Name: [(3S)-3-(4-fluoro-3-methylphenyl)-3-(4-fluorophenoxy)propyl]azanium Traditional Name: [(3S)-3-(4-fluoro-3-methyl-phenyl)-3-(4-fluorophenoxy)propyl]ammonium Formula: C16H18F2NO+ MolecularWeight: 278.317026

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(CC[NH3+])OC2=CC=C(C=C2)F)F

Isomeric SMILES

CC1=C(C=CC(=C1)[C@H](CC[NH3+])OC2=CC=C(C=C2)F)F

InChI

InChI=1S/C16H17F2NO/c1-11-10-12(2-7-15(11)18)16(8-9-19)20-14-5-3-13(17)4-6-14/h2-7,10,16H,8-9,19H2,1H3/p+1/t16-/m0/s1