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

Systemtic Name: (2S)-2-azaniumyl-2-[4-[bis(fluoranyl)methoxy]-3-ethoxy-phenyl]ethanoate Openeye Name: (2S)-2-azaniumyl-2-[4-(difluoromethoxy)-3-ethoxy-phenyl]acetate CAS Name: (2S)-2-ammonio-2-[4-(difluoromethoxy)-3-ethoxyphenyl]acetate IUPAC Name: (2S)-2-azaniumyl-2-[4-(difluoromethoxy)-3-ethoxyphenyl]acetate Traditional Name: (2S)-2-ammonio-2-[4-(difluoromethoxy)-3-ethoxy-phenyl]acetate Formula: C11H13F2NO4 MolecularWeight: 261.222026

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C(C(=O)[O-])[NH3+])OC(F)F

Isomeric SMILES

CCOC1=C(C=CC(=C1)[C@@H](C(=O)[O-])[NH3+])OC(F)F

InChI

InChI=1S/C11H13F2NO4/c1-2-17-8-5-6(9(14)10(15)16)3-4-7(8)18-11(12)13/h3-5,9,11H,2,14H2,1H3,(H,15,16)/t9-/m0/s1