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

Systemtic Name: [(2S)-3-(2-chloranyl-4-fluoranyl-phenoxy)-2-oxidanyl-propyl]-(2-methoxyethyl)azanium Openeye Name: [(2S)-3-(2-chloro-4-fluoro-phenoxy)-2-hydroxy-propyl]-(2-methoxyethyl)ammonium CAS Name: [(2S)-3-(2-chloro-4-fluorophenoxy)-2-hydroxypropyl]-(2-methoxyethyl)ammonium IUPAC Name: [(2S)-3-(2-chloro-4-fluorophenoxy)-2-hydroxypropyl]-(2-methoxyethyl)azanium Traditional Name: [(2S)-3-(2-chloro-4-fluoro-phenoxy)-2-hydroxy-propyl]-(2-methoxyethyl)ammonium Formula: C12H18ClFNO3+ MolecularWeight: 278.727623

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H17ClFNO3/c1-17-5-4-15-7-10(16)8-18-12-3-2-9(14)6-11(12)13/h2-3,6,10,15-16H,4-5,7-8H2,1H3/p+1/t10-/m0/s1