5-tert-butyl-3-methyl-1-benzofuran-2-carboxylic acid

Systemtic Name: 5-tert-butyl-3-methyl-1-benzofuran-2-carboxylic acid Openeye Name: 5-tert-butyl-3-methyl-benzofuran-2-carboxylic acid CAS Name: 5-tert-butyl-3-methyl-2-benzofurancarboxylic acid IUPAC Name: 5-tert-butyl-3-methyl-1-benzofuran-2-carboxylic acid Traditional Name: 5-tert-butyl-3-methyl-coumarilic acid Formula: C14H16O3 MolecularWeight: 232.27504

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C=C(C=C2)C(C)(C)C)C(=O)O

Isomeric SMILES

CC1=C(OC2=C1C=C(C=C2)C(C)(C)C)C(=O)O

InChI

InChI=1S/C14H16O3/c1-8-10-7-9(14(2,3)4)5-6-11(10)17-12(8)13(15)16/h5-7H,1-4H3,(H,15,16)