(5R)-5-azaniumyl-5-[3,4-bis(fluoranyl)phenyl]pentanoate

Systemtic Name: (5R)-5-azaniumyl-5-[3,4-bis(fluoranyl)phenyl]pentanoate Openeye Name: (5R)-5-azaniumyl-5-(3,4-difluorophenyl)pentanoate CAS Name: (5R)-5-ammonio-5-(3,4-difluorophenyl)pentanoate IUPAC Name: (5R)-5-azaniumyl-5-(3,4-difluorophenyl)pentanoate Traditional Name: (5R)-5-ammonio-5-(3,4-difluorophenyl)valerate Formula: C11H13F2NO2 MolecularWeight: 229.223226

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(CCCC(=O)[O-])[NH3+])F)F

Isomeric SMILES

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

InChI

InChI=1S/C11H13F2NO2/c12-8-5-4-7(6-9(8)13)10(14)2-1-3-11(15)16/h4-6,10H,1-3,14H2,(H,15,16)/t10-/m1/s1