5-tert-butyl-3-(4-fluorophenyl)carbonyl-2-methyl-6-oxidanyl-benzoic acid

Systemtic Name: 5-tert-butyl-3-(4-fluorophenyl)carbonyl-2-methyl-6-oxidanyl-benzoic acid Openeye Name: 3-tert-butyl-5-(4-fluorobenzoyl)-2-hydroxy-6-methyl-benzoic acid CAS Name: 3-tert-butyl-5-[(4-fluorophenyl)-oxomethyl]-2-hydroxy-6-methylbenzoic acid IUPAC Name: 3-tert-butyl-5-(4-fluorobenzoyl)-2-hydroxy-6-methylbenzoic acid Traditional Name: 3-tert-butyl-5-(4-fluorobenzoyl)-2-hydroxy-6-methyl-benzoic acid Formula: C19H19FO4 MolecularWeight: 330.350163

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1C(=O)C2=CC=C(C=C2)F)C(C)(C)C)O)C(=O)O

Isomeric SMILES

CC1=C(C(=C(C=C1C(=O)C2=CC=C(C=C2)F)C(C)(C)C)O)C(=O)O

InChI

InChI=1S/C19H19FO4/c1-10-13(16(21)11-5-7-12(20)8-6-11)9-14(19(2,3)4)17(22)15(10)18(23)24/h5-9,22H,1-4H3,(H,23,24)