3-[4-[[4-(trifluoromethyl)phenyl]methylamino]phenyl]propanoic acid

Systemtic Name: 3-[4-[[4-(trifluoromethyl)phenyl]methylamino]phenyl]propanoic acid Openeye Name: 3-[4-[[4-(trifluoromethyl)phenyl]methylamino]phenyl]propanoic acid CAS Name: 3-[4-[[4-(trifluoromethyl)phenyl]methylamino]phenyl]propanoic acid IUPAC Name: 3-[4-[[4-(trifluoromethyl)phenyl]methylamino]phenyl]propanoic acid Traditional Name: 3-[4-[[4-(trifluoromethyl)benzyl]amino]phenyl]propionic acid Formula: C17H16F3NO2 MolecularWeight: 323.30965

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCC(=O)O)NCC2=CC=C(C=C2)C(F)(F)F

Isomeric SMILES

C1=CC(=CC=C1CCC(=O)O)NCC2=CC=C(C=C2)C(F)(F)F

InChI

InChI=1S/C17H16F3NO2/c18-17(19,20)14-6-1-13(2-7-14)11-21-15-8-3-12(4-9-15)5-10-16(22)23/h1-4,6-9,21H,5,10-11H2,(H,22,23)