[3-oxidanylidene-2-(pyridin-3-ylmethylidene)-1-benzofuran-6-yl] 2-methyl-5-phenylmethoxy-1-benzofuran-3-carboxylate

Systemtic Name: [3-oxidanylidene-2-(pyridin-3-ylmethylidene)-1-benzofuran-6-yl] 2-methyl-5-phenylmethoxy-1-benzofuran-3-carboxylate Openeye Name: [3-oxo-2-(3-pyridylmethylene)benzofuran-6-yl] 5-benzyloxy-2-methyl-benzofuran-3-carboxylate CAS Name: 2-methyl-5-phenylmethoxy-3-benzofurancarboxylic acid [3-oxo-2-(3-pyridinylmethylidene)-6-benzofuranyl] ester IUPAC Name: [3-oxo-2-(pyridin-3-ylmethylidene)-1-benzofuran-6-yl] 2-methyl-5-phenylmethoxy-1-benzofuran-3-carboxylate Traditional Name: 5-benzoxy-2-methyl-benzofuran-3-carboxylic acid [3-keto-2-(3-pyridylmethylene)coumaran-6-yl] ester Formula: C31H21NO6 MolecularWeight: 503.50154

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(O1)C=CC(=C2)OCC3=CC=CC=C3)C(=O)OC4=CC5=C(C=C4)C(=O)C(=CC6=CN=CC=C6)O5

Isomeric SMILES

CC1=C(C2=C(O1)C=CC(=C2)OCC3=CC=CC=C3)C(=O)OC4=CC5=C(C=C4)C(=O)C(=CC6=CN=CC=C6)O5

InChI

InChI=1S/C31H21NO6/c1-19-29(25-15-22(10-12-26(25)36-19)35-18-20-6-3-2-4-7-20)31(34)37-23-9-11-24-27(16-23)38-28(30(24)33)14-21-8-5-13-32-17-21/h2-17H,18H2,1H3