2-chloranyl-3-[[3,3,3-tris(fluoranyl)-2-methyl-2-oxidanyl-propanoyl]amino]benzoic acid

Systemtic Name: 2-chloranyl-3-[[3,3,3-tris(fluoranyl)-2-methyl-2-oxidanyl-propanoyl]amino]benzoic acid Openeye Name: 2-chloro-3-[(3,3,3-trifluoro-2-hydroxy-2-methyl-propanoyl)amino]benzoic acid CAS Name: 2-chloro-3-[(3,3,3-trifluoro-2-hydroxy-2-methyl-1-oxopropyl)amino]benzoic acid IUPAC Name: 2-chloro-3-[(3,3,3-trifluoro-2-hydroxy-2-methylpropanoyl)amino]benzoic acid Traditional Name: 2-chloro-3-[(3,3,3-trifluoro-2-hydroxy-2-methyl-propanoyl)amino]benzoic acid Formula: C11H9ClF3NO4 MolecularWeight: 311.64167

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC(=C1Cl)C(=O)O)(C(F)(F)F)O

Isomeric SMILES

CC(C(=O)NC1=CC=CC(=C1Cl)C(=O)O)(C(F)(F)F)O

InChI

InChI=1S/C11H9ClF3NO4/c1-10(20,11(13,14)15)9(19)16-6-4-2-3-5(7(6)12)8(17)18/h2-4,20H,1H3,(H,16,19)(H,17,18)