(5-bromanyl-2-ethoxycarbonyl-1-benzofuran-3-yl)methyl pyridine-4-carboxylate

Systemtic Name: (5-bromanyl-2-ethoxycarbonyl-1-benzofuran-3-yl)methyl pyridine-4-carboxylate Openeye Name: (5-bromo-2-ethoxycarbonyl-benzofuran-3-yl)methyl pyridine-4-carboxylate CAS Name: 4-pyridinecarboxylic acid (5-bromo-2-ethoxycarbonyl-3-benzofuranyl)methyl ester IUPAC Name: (5-bromo-2-ethoxycarbonyl-1-benzofuran-3-yl)methyl pyridine-4-carboxylate Traditional Name: isonicotinic acid (5-bromo-2-carbethoxy-benzofuran-3-yl)methyl ester Formula: C18H14BrNO5 MolecularWeight: 404.21146

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(O1)C=CC(=C2)Br)COC(=O)C3=CC=NC=C3

Isomeric SMILES

CCOC(=O)C1=C(C2=C(O1)C=CC(=C2)Br)COC(=O)C3=CC=NC=C3

InChI

InChI=1S/C18H14BrNO5/c1-2-23-18(22)16-14(13-9-12(19)3-4-15(13)25-16)10-24-17(21)11-5-7-20-8-6-11/h3-9H,2,10H2,1H3