3-methyl-5-propan-2-yl-1-benzofuran-2-carboxylic acid

Systemtic Name: 3-methyl-5-propan-2-yl-1-benzofuran-2-carboxylic acid Openeye Name: 5-isopropyl-3-methyl-benzofuran-2-carboxylic acid CAS Name: 3-methyl-5-propan-2-yl-2-benzofurancarboxylic acid IUPAC Name: 3-methyl-5-propan-2-yl-1-benzofuran-2-carboxylic acid Traditional Name: 5-isopropyl-3-methyl-coumarilic acid Formula: C13H14O3 MolecularWeight: 218.24846

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H14O3/c1-7(2)9-4-5-11-10(6-9)8(3)12(16-11)13(14)15/h4-7H,1-3H3,(H,14,15)