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

Systemtic Name: 3-[(5-chloranylpyridin-2-yl)methyl]-1-benzofuran-2-carboxylic acid Openeye Name: 3-[(5-chloro-2-pyridyl)methyl]benzofuran-2-carboxylic acid CAS Name: 3-[(5-chloro-2-pyridinyl)methyl]-2-benzofurancarboxylic acid IUPAC Name: 3-[(5-chloropyridin-2-yl)methyl]-1-benzofuran-2-carboxylic acid Traditional Name: 3-[(5-chloro-2-pyridyl)methyl]coumarilic acid Formula: C15H10ClNO3 MolecularWeight: 287.6978

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C(O2)C(=O)O)CC3=NC=C(C=C3)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=C(O2)C(=O)O)CC3=NC=C(C=C3)Cl

InChI

InChI=1S/C15H10ClNO3/c16-9-5-6-10(17-8-9)7-12-11-3-1-2-4-13(11)20-14(12)15(18)19/h1-6,8H,7H2,(H,18,19)