7-ethanoyl-3-methyl-6-oxidanyl-1-benzofuran-2-carboxylic acid

Systemtic Name: 7-ethanoyl-3-methyl-6-oxidanyl-1-benzofuran-2-carboxylic acid Openeye Name: 7-acetyl-6-hydroxy-3-methyl-benzofuran-2-carboxylic acid CAS Name: 7-acetyl-6-hydroxy-3-methyl-2-benzofurancarboxylic acid IUPAC Name: 7-acetyl-6-hydroxy-3-methyl-1-benzofuran-2-carboxylic acid Traditional Name: 7-acetyl-6-hydroxy-3-methyl-coumarilic acid Formula: C12H10O5 MolecularWeight: 234.2048

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H10O5/c1-5-7-3-4-8(14)9(6(2)13)11(7)17-10(5)12(15)16/h3-4,14H,1-2H3,(H,15,16)