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

Systemtic Name: 3-[[4-(trifluoromethyl)phenyl]methylamino]benzoic acid Openeye Name: 3-[[4-(trifluoromethyl)phenyl]methylamino]benzoic acid CAS Name: 3-[[4-(trifluoromethyl)phenyl]methylamino]benzoic acid IUPAC Name: 3-[[4-(trifluoromethyl)phenyl]methylamino]benzoic acid Traditional Name: 3-[[4-(trifluoromethyl)benzyl]amino]benzoic acid Formula: C15H12F3NO2 MolecularWeight: 295.25649

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H12F3NO2/c16-15(17,18)12-6-4-10(5-7-12)9-19-13-3-1-2-11(8-13)14(20)21/h1-8,19H,9H2,(H,20,21)