(3-oxidanylidene-1H-2-benzofuran-1-yl) 5-butoxypyridine-2-carboxylate

Systemtic Name: (3-oxidanylidene-1H-2-benzofuran-1-yl) 5-butoxypyridine-2-carboxylate Openeye Name: (3-oxo-1H-isobenzofuran-1-yl) 5-butoxypyridine-2-carboxylate CAS Name: 5-butoxy-2-pyridinecarboxylic acid (3-oxo-1H-isobenzofuran-1-yl) ester IUPAC Name: (3-oxo-1H-2-benzofuran-1-yl) 5-butoxypyridine-2-carboxylate Traditional Name: 5-butoxypicolinic acid phthalidyl ester Formula: C18H17NO5 MolecularWeight: 327.33128

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CN=C(C=C1)C(=O)OC2C3=CC=CC=C3C(=O)O2

Isomeric SMILES

CCCCOC1=CN=C(C=C1)C(=O)OC2C3=CC=CC=C3C(=O)O2

InChI

InChI=1S/C18H17NO5/c1-2-3-10-22-12-8-9-15(19-11-12)17(21)24-18-14-7-5-4-6-13(14)16(20)23-18/h4-9,11,18H,2-3,10H2,1H3