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

Systemtic Name: [(3S)-3-(2-chloranyl-4-fluoranyl-phenoxy)-3-(2-methoxyphenyl)propyl]azanium Openeye Name: [(3S)-3-(2-chloro-4-fluoro-phenoxy)-3-(2-methoxyphenyl)propyl]ammonium CAS Name: [(3S)-3-(2-chloro-4-fluorophenoxy)-3-(2-methoxyphenyl)propyl]ammonium IUPAC Name: [(3S)-3-(2-chloro-4-fluorophenoxy)-3-(2-methoxyphenyl)propyl]azanium Traditional Name: [(3S)-3-(2-chloro-4-fluoro-phenoxy)-3-(2-methoxyphenyl)propyl]ammonium Formula: C16H18ClFNO2+ MolecularWeight: 310.771023

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(CC[NH3+])OC2=C(C=C(C=C2)F)Cl

Isomeric SMILES

COC1=CC=CC=C1[C@H](CC[NH3+])OC2=C(C=C(C=C2)F)Cl

InChI

InChI=1S/C16H17ClFNO2/c1-20-14-5-3-2-4-12(14)15(8-9-19)21-16-7-6-11(18)10-13(16)17/h2-7,10,15H,8-9,19H2,1H3/p+1/t15-/m0/s1