(2S)-2-azaniumyl-2-[3-[bis(fluoranyl)methoxy]-4-methoxy-phenyl]ethanoate

Systemtic Name: (2S)-2-azaniumyl-2-[3-[bis(fluoranyl)methoxy]-4-methoxy-phenyl]ethanoate Openeye Name: (2S)-2-azaniumyl-2-[3-(difluoromethoxy)-4-methoxy-phenyl]acetate CAS Name: (2S)-2-ammonio-2-[3-(difluoromethoxy)-4-methoxyphenyl]acetate IUPAC Name: (2S)-2-azaniumyl-2-[3-(difluoromethoxy)-4-methoxyphenyl]acetate Traditional Name: (2S)-2-ammonio-2-[3-(difluoromethoxy)-4-methoxy-phenyl]acetate Formula: C10H11F2NO4 MolecularWeight: 247.195446

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(C(=O)[O-])[NH3+])OC(F)F

Isomeric SMILES

COC1=C(C=C(C=C1)[C@@H](C(=O)[O-])[NH3+])OC(F)F

InChI

InChI=1S/C10H11F2NO4/c1-16-6-3-2-5(8(13)9(14)15)4-7(6)17-10(11)12/h2-4,8,10H,13H2,1H3,(H,14,15)/t8-/m0/s1