7-tert-butyl-3-methyl-4-oxidanyl-1-benzofuran-2-carboxylic acid

Systemtic Name: 7-tert-butyl-3-methyl-4-oxidanyl-1-benzofuran-2-carboxylic acid Openeye Name: 7-tert-butyl-4-hydroxy-3-methyl-benzofuran-2-carboxylic acid CAS Name: 7-tert-butyl-4-hydroxy-3-methyl-2-benzofurancarboxylic acid IUPAC Name: 7-tert-butyl-4-hydroxy-3-methyl-1-benzofuran-2-carboxylic acid Traditional Name: 7-tert-butyl-4-hydroxy-3-methyl-coumarilic acid Formula: C14H16O4 MolecularWeight: 248.27444

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C(C=CC(=C12)O)C(C)(C)C)C(=O)O

Isomeric SMILES

CC1=C(OC2=C(C=CC(=C12)O)C(C)(C)C)C(=O)O

InChI

InChI=1S/C14H16O4/c1-7-10-9(15)6-5-8(14(2,3)4)12(10)18-11(7)13(16)17/h5-6,15H,1-4H3,(H,16,17)