5-[[2,5-bis(fluoranyl)phenyl]amino]pentanoate

Systemtic Name: 5-[[2,5-bis(fluoranyl)phenyl]amino]pentanoate Openeye Name: 5-(2,5-difluoroanilino)pentanoate CAS Name: 5-(2,5-difluoroanilino)pentanoate IUPAC Name: 5-(2,5-difluoroanilino)pentanoate Traditional Name: 5-(2,5-difluoroanilino)valerate Formula: C11H12F2NO2- MolecularWeight: 228.215286

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1F)NCCCCC(=O)[O-])F

Isomeric SMILES

C1=CC(=C(C=C1F)NCCCCC(=O)[O-])F

InChI

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