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

Systemtic Name: 4-[2-[3,5-bis(chloranyl)pyridin-4-yl]ethyl]-7-methoxy-1-benzofuran-2-carboxylic acid Openeye Name: 4-[2-(3,5-dichloro-4-pyridyl)ethyl]-7-methoxy-benzofuran-2-carboxylic acid CAS Name: 4-[2-(3,5-dichloro-4-pyridinyl)ethyl]-7-methoxy-2-benzofurancarboxylic acid IUPAC Name: 4-[2-(3,5-dichloropyridin-4-yl)ethyl]-7-methoxy-1-benzofuran-2-carboxylic acid Traditional Name: 4-[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=C2C(=C(C=C1)CCC3=C(C=NC=C3Cl)Cl)C=C(O2)C(=O)O

Isomeric SMILES

COC1=C2C(=C(C=C1)CCC3=C(C=NC=C3Cl)Cl)C=C(O2)C(=O)O

InChI

InChI=1S/C17H13Cl2NO4/c1-23-14-5-3-9(11-6-15(17(21)22)24-16(11)14)2-4-10-12(18)7-20-8-13(10)19/h3,5-8H,2,4H2,1H3,(H,21,22)