3-[1-benzofuran-2-yl-propoxy-(pyridin-3-ylmethylamino)methoxy]-1-benzofuran-2-carboxylic acid

Systemtic Name: 3-[1-benzofuran-2-yl-propoxy-(pyridin-3-ylmethylamino)methoxy]-1-benzofuran-2-carboxylic acid Openeye Name: 3-[benzofuran-2-yl-propoxy-(3-pyridylmethylamino)methoxy]benzofuran-2-carboxylic acid CAS Name: 3-[2-benzofuranyl-propoxy-(3-pyridinylmethylamino)methoxy]-2-benzofurancarboxylic acid IUPAC Name: 3-[1-benzofuran-2-yl-propoxy-(pyridin-3-ylmethylamino)methoxy]-1-benzofuran-2-carboxylic acid Traditional Name: 3-[benzofuran-2-yl-propoxy-(3-pyridylmethylamino)methoxy]coumarilic acid Formula: C27H24N2O6 MolecularWeight: 472.48926

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(C1=CC2=CC=CC=C2O1)(NCC3=CN=CC=C3)OC4=C(OC5=CC=CC=C54)C(=O)O

Isomeric SMILES

CCCOC(C1=CC2=CC=CC=C2O1)(NCC3=CN=CC=C3)OC4=C(OC5=CC=CC=C54)C(=O)O

InChI

InChI=1S/C27H24N2O6/c1-2-14-32-27(29-17-18-8-7-13-28-16-18,23-15-19-9-3-5-11-21(19)33-23)35-24-20-10-4-6-12-22(20)34-25(24)26(30)31/h3-13,15-16,29H,2,14,17H2,1H3,(H,30,31)