4-[[[3,5-bis(trifluoromethyl)phenyl]carbonylamino]methyl]benzoic acid

Systemtic Name: 4-[[[3,5-bis(trifluoromethyl)phenyl]carbonylamino]methyl]benzoic acid Openeye Name: 4-[[[3,5-bis(trifluoromethyl)benzoyl]amino]methyl]benzoic acid CAS Name: 4-[[[[3,5-bis(trifluoromethyl)phenyl]-oxomethyl]amino]methyl]benzoic acid IUPAC Name: 4-[[[3,5-bis(trifluoromethyl)benzoyl]amino]methyl]benzoic acid Traditional Name: 4-[[[3,5-bis(trifluoromethyl)benzoyl]amino]methyl]benzoic acid Formula: C17H11F6NO3 MolecularWeight: 391.264559

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNC(=O)C2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)C(=O)O

Isomeric SMILES

C1=CC(=CC=C1CNC(=O)C2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)C(=O)O

InChI

InChI=1S/C17H11F6NO3/c18-16(19,20)12-5-11(6-13(7-12)17(21,22)23)14(25)24-8-9-1-3-10(4-2-9)15(26)27/h1-7H,8H2,(H,24,25)(H,26,27)