5-cyano-3-methyl-1-benzofuran-2-carboxylic acid

Systemtic Name: 5-cyano-3-methyl-1-benzofuran-2-carboxylic acid Openeye Name: 5-cyano-3-methyl-benzofuran-2-carboxylic acid CAS Name: 5-cyano-3-methyl-2-benzofurancarboxylic acid IUPAC Name: 5-cyano-3-methyl-1-benzofuran-2-carboxylic acid Traditional Name: 5-cyano-3-methyl-coumarilic acid Formula: C11H7NO3 MolecularWeight: 201.17818

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H7NO3/c1-6-8-4-7(5-12)2-3-9(8)15-10(6)11(13)14/h2-4H,1H3,(H,13,14)