3-[2-[3,5-bis(chloranyl)pyridin-4-yl]ethyl]-7-methoxy-1-benzofuran-2-carboxylic acid

Systemtic Name: 3-[2-[3,5-bis(chloranyl)pyridin-4-yl]ethyl]-7-methoxy-1-benzofuran-2-carboxylic acid Openeye Name: 3-[2-(3,5-dichloro-4-pyridyl)ethyl]-7-methoxy-benzofuran-2-carboxylic acid CAS Name: 3-[2-(3,5-dichloro-4-pyridinyl)ethyl]-7-methoxy-2-benzofurancarboxylic acid IUPAC Name: 3-[2-(3,5-dichloropyridin-4-yl)ethyl]-7-methoxy-1-benzofuran-2-carboxylic acid Traditional Name: 3-[2-(3,5-dichloro-4-pyridyl)ethyl]-7-methoxy-coumarilic acid Formula: C17H13Cl2NO4 MolecularWeight: 366.19542

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=C1OC(=C2CCC3=C(C=NC=C3Cl)Cl)C(=O)O

Isomeric SMILES

COC1=CC=CC2=C1OC(=C2CCC3=C(C=NC=C3Cl)Cl)C(=O)O

InChI

InChI=1S/C17H13Cl2NO4/c1-23-14-4-2-3-9-10(16(17(21)22)24-15(9)14)5-6-11-12(18)7-20-8-13(11)19/h2-4,7-8H,5-6H2,1H3,(H,21,22)