[(2S)-3-(2-chloranyl-4-fluoranyl-phenoxy)-2-oxidanyl-propyl]-(2-methylpropyl)azanium

Systemtic Name: [(2S)-3-(2-chloranyl-4-fluoranyl-phenoxy)-2-oxidanyl-propyl]-(2-methylpropyl)azanium Openeye Name: [(2S)-3-(2-chloro-4-fluoro-phenoxy)-2-hydroxy-propyl]-isobutyl-ammonium CAS Name: [(2S)-3-(2-chloro-4-fluorophenoxy)-2-hydroxypropyl]-(2-methylpropyl)ammonium IUPAC Name: [(2S)-3-(2-chloro-4-fluorophenoxy)-2-hydroxypropyl]-(2-methylpropyl)azanium Traditional Name: [(2S)-3-(2-chloro-4-fluoro-phenoxy)-2-hydroxy-propyl]-isobutyl-ammonium Formula: C13H20ClFNO2+ MolecularWeight: 276.754803

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C[NH2+]CC(COC1=C(C=C(C=C1)F)Cl)O

Isomeric SMILES

CC(C)C[NH2+]C[C@@H](COC1=C(C=C(C=C1)F)Cl)O

InChI

InChI=1S/C13H19ClFNO2/c1-9(2)6-16-7-11(17)8-18-13-4-3-10(15)5-12(13)14/h3-5,9,11,16-17H,6-8H2,1-2H3/p+1/t11-/m0/s1