5-tert-butyl-3-methyl-4-oxidanyl-7-(phenylcarbonyl)-1-benzofuran-2-carboxylic acid

Systemtic Name: 5-tert-butyl-3-methyl-4-oxidanyl-7-(phenylcarbonyl)-1-benzofuran-2-carboxylic acid Openeye Name: 7-benzoyl-5-tert-butyl-4-hydroxy-3-methyl-benzofuran-2-carboxylic acid CAS Name: 7-benzoyl-5-tert-butyl-4-hydroxy-3-methyl-2-benzofurancarboxylic acid IUPAC Name: 7-benzoyl-5-tert-butyl-4-hydroxy-3-methyl-1-benzofuran-2-carboxylic acid Traditional Name: 7-benzoyl-5-tert-butyl-4-hydroxy-3-methyl-coumarilic acid Formula: C21H20O5 MolecularWeight: 352.3805

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C(=C(C=C2C(=O)C3=CC=CC=C3)C(C)(C)C)O)C(=O)O

Isomeric SMILES

CC1=C(OC2=C1C(=C(C=C2C(=O)C3=CC=CC=C3)C(C)(C)C)O)C(=O)O

InChI

InChI=1S/C21H20O5/c1-11-15-17(23)14(21(2,3)4)10-13(19(15)26-18(11)20(24)25)16(22)12-8-6-5-7-9-12/h5-10,23H,1-4H3,(H,24,25)