5-[oxidanyl(pyridin-3-yl)methyl]-1-benzofuran-2-carboxylic acid

Systemtic Name: 5-[oxidanyl(pyridin-3-yl)methyl]-1-benzofuran-2-carboxylic acid Openeye Name: 5-[hydroxy(3-pyridyl)methyl]benzofuran-2-carboxylic acid CAS Name: 5-[hydroxy(3-pyridinyl)methyl]-2-benzofurancarboxylic acid IUPAC Name: 5-[hydroxy(pyridin-3-yl)methyl]-1-benzofuran-2-carboxylic acid Traditional Name: 5-[hydroxy(3-pyridyl)methyl]coumarilic acid Formula: C15H11NO4 MolecularWeight: 269.25214

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)C(C2=CC3=C(C=C2)OC(=C3)C(=O)O)O

Isomeric SMILES

C1=CC(=CN=C1)C(C2=CC3=C(C=C2)OC(=C3)C(=O)O)O

InChI

InChI=1S/C15H11NO4/c17-14(10-2-1-5-16-8-10)9-3-4-12-11(6-9)7-13(20-12)15(18)19/h1-8,14,17H,(H,18,19)