4-[[[3-(trifluoromethyl)phenyl]carbamoylamino]methyl]benzoic acid

Systemtic Name: 4-[[[3-(trifluoromethyl)phenyl]carbamoylamino]methyl]benzoic acid Openeye Name: 4-[[[3-(trifluoromethyl)phenyl]carbamoylamino]methyl]benzoic acid CAS Name: 4-[[[oxo-[3-(trifluoromethyl)anilino]methyl]amino]methyl]benzoic acid IUPAC Name: 4-[[[3-(trifluoromethyl)phenyl]carbamoylamino]methyl]benzoic acid Traditional Name: 4-[[[3-(trifluoromethyl)phenyl]carbamoylamino]methyl]benzoic acid Formula: C16H13F3N2O3 MolecularWeight: 338.28123

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H13F3N2O3/c17-16(18,19)12-2-1-3-13(8-12)21-15(24)20-9-10-4-6-11(7-5-10)14(22)23/h1-8H,9H2,(H,22,23)(H2,20,21,24)