pyridin-3-ylmethyl 2-[4-(1-benzofuran-2-yl)phenoxy]heptanoate

Systemtic Name: pyridin-3-ylmethyl 2-[4-(1-benzofuran-2-yl)phenoxy]heptanoate Openeye Name: 3-pyridylmethyl 2-[4-(benzofuran-2-yl)phenoxy]heptanoate CAS Name: 2-[4-(2-benzofuranyl)phenoxy]heptanoic acid 3-pyridinylmethyl ester IUPAC Name: pyridin-3-ylmethyl 2-[4-(1-benzofuran-2-yl)phenoxy]heptanoate Traditional Name: 2-[4-(benzofuran-2-yl)phenoxy]enanthic acid 3-pyridylmethyl ester Formula: C27H27NO4 MolecularWeight: 429.50758

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C(=O)OCC1=CN=CC=C1)OC2=CC=C(C=C2)C3=CC4=CC=CC=C4O3

Isomeric SMILES

CCCCCC(C(=O)OCC1=CN=CC=C1)OC2=CC=C(C=C2)C3=CC4=CC=CC=C4O3

InChI

InChI=1S/C27H27NO4/c1-2-3-4-11-25(27(29)30-19-20-8-7-16-28-18-20)31-23-14-12-21(13-15-23)26-17-22-9-5-6-10-24(22)32-26/h5-10,12-18,25H,2-4,11,19H2,1H3