2-[[2-carboxyethyl-[3-(trifluoromethyl)phenyl]amino]methyl]benzoic acid

Systemtic Name: 2-[[2-carboxyethyl-[3-(trifluoromethyl)phenyl]amino]methyl]benzoic acid Openeye Name: 2-[[N-(2-carboxyethyl)-3-(trifluoromethyl)anilino]methyl]benzoic acid CAS Name: 2-[[N-(2-carboxyethyl)-3-(trifluoromethyl)anilino]methyl]benzoic acid IUPAC Name: 2-[[N-(2-carboxyethyl)-3-(trifluoromethyl)anilino]methyl]benzoic acid Traditional Name: 2-[[N-(2-carboxyethyl)-3-(trifluoromethyl)anilino]methyl]benzoic acid Formula: C18H16F3NO4 MolecularWeight: 367.31915

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CN(CCC(=O)O)C2=CC=CC(=C2)C(F)(F)F)C(=O)O

Isomeric SMILES

C1=CC=C(C(=C1)CN(CCC(=O)O)C2=CC=CC(=C2)C(F)(F)F)C(=O)O

InChI

InChI=1S/C18H16F3NO4/c19-18(20,21)13-5-3-6-14(10-13)22(9-8-16(23)24)11-12-4-1-2-7-15(12)17(25)26/h1-7,10H,8-9,11H2,(H,23,24)(H,25,26)