(4R)-4-azaniumyl-4-[2,5-bis(fluoranyl)phenyl]butanoate

Systemtic Name: (4R)-4-azaniumyl-4-[2,5-bis(fluoranyl)phenyl]butanoate Openeye Name: (4R)-4-azaniumyl-4-(2,5-difluorophenyl)butanoate CAS Name: (4R)-4-ammonio-4-(2,5-difluorophenyl)butanoate IUPAC Name: (4R)-4-azaniumyl-4-(2,5-difluorophenyl)butanoate Traditional Name: (4R)-4-ammonio-4-(2,5-difluorophenyl)butyrate Formula: C10H11F2NO2 MolecularWeight: 215.196646

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1F)C(CCC(=O)[O-])[NH3+])F

Isomeric SMILES

C1=CC(=C(C=C1F)[C@@H](CCC(=O)[O-])[NH3+])F

InChI

InChI=1S/C10H11F2NO2/c11-6-1-2-8(12)7(5-6)9(13)3-4-10(14)15/h1-2,5,9H,3-4,13H2,(H,14,15)/t9-/m1/s1