5-(2-pyridin-3-ylethyl)-1-benzofuran-2-carboxylic acid

Systemtic Name: 5-(2-pyridin-3-ylethyl)-1-benzofuran-2-carboxylic acid Openeye Name: 5-[2-(3-pyridyl)ethyl]benzofuran-2-carboxylic acid CAS Name: 5-[2-(3-pyridinyl)ethyl]-2-benzofurancarboxylic acid IUPAC Name: 5-(2-pyridin-3-ylethyl)-1-benzofuran-2-carboxylic acid Traditional Name: 5-[2-(3-pyridyl)ethyl]coumarilic acid Formula: C16H13NO3 MolecularWeight: 267.27932

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)CCC2=CC3=C(C=C2)OC(=C3)C(=O)O

Isomeric SMILES

C1=CC(=CN=C1)CCC2=CC3=C(C=C2)OC(=C3)C(=O)O

InChI

InChI=1S/C16H13NO3/c18-16(19)15-9-13-8-11(5-6-14(13)20-15)3-4-12-2-1-7-17-10-12/h1-2,5-10H,3-4H2,(H,18,19)