5-oxidanylidene-5-[[3-(trifluoromethyl)phenyl]methylamino]pentanoic acid

Systemtic Name: 5-oxidanylidene-5-[[3-(trifluoromethyl)phenyl]methylamino]pentanoic acid Openeye Name: 5-oxo-5-[[3-(trifluoromethyl)phenyl]methylamino]pentanoic acid CAS Name: 5-oxo-5-[[3-(trifluoromethyl)phenyl]methylamino]pentanoic acid IUPAC Name: 5-oxo-5-[[3-(trifluoromethyl)phenyl]methylamino]pentanoic acid Traditional Name: 5-keto-5-[[3-(trifluoromethyl)benzyl]amino]valeric acid Formula: C13H14F3NO3 MolecularWeight: 289.25037

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(F)(F)F)CNC(=O)CCCC(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)C(F)(F)F)CNC(=O)CCCC(=O)O

InChI

InChI=1S/C13H14F3NO3/c14-13(15,16)10-4-1-3-9(7-10)8-17-11(18)5-2-6-12(19)20/h1,3-4,7H,2,5-6,8H2,(H,17,18)(H,19,20)