4-[(3,5-ditert-butyl-2-oxidanyl-phenyl)carbamoyl]-2-fluoranyl-benzoic acid

Systemtic Name: 4-[(3,5-ditert-butyl-2-oxidanyl-phenyl)carbamoyl]-2-fluoranyl-benzoic acid Openeye Name: 4-[(3,5-ditert-butyl-2-hydroxy-phenyl)carbamoyl]-2-fluoro-benzoic acid CAS Name: 4-[(3,5-ditert-butyl-2-hydroxyanilino)-oxomethyl]-2-fluorobenzoic acid IUPAC Name: 4-[(3,5-ditert-butyl-2-hydroxyphenyl)carbamoyl]-2-fluorobenzoic acid Traditional Name: 4-[(3,5-ditert-butyl-2-hydroxy-phenyl)carbamoyl]-2-fluoro-benzoic acid Formula: C22H26FNO4 MolecularWeight: 387.444543

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H26FNO4/c1-21(2,3)13-10-15(22(4,5)6)18(25)17(11-13)24-19(26)12-7-8-14(20(27)28)16(23)9-12/h7-11,25H,1-6H3,(H,24,26)(H,27,28)