(4-nitrophenyl) 3-(phenoxymethyl)-1-benzofuran-2-carboxylate

Systemtic Name: (4-nitrophenyl) 3-(phenoxymethyl)-1-benzofuran-2-carboxylate Openeye Name: (4-nitrophenyl) 3-(phenoxymethyl)benzofuran-2-carboxylate CAS Name: 3-(phenoxymethyl)-2-benzofurancarboxylic acid (4-nitrophenyl) ester IUPAC Name: (4-nitrophenyl) 3-(phenoxymethyl)-1-benzofuran-2-carboxylate Traditional Name: 3-(phenoxymethyl)coumarilic acid (4-nitrophenyl) ester Formula: C22H15NO6 MolecularWeight: 389.3576

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCC2=C(OC3=CC=CC=C32)C(=O)OC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)OCC2=C(OC3=CC=CC=C32)C(=O)OC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H15NO6/c24-22(28-17-12-10-15(11-13-17)23(25)26)21-19(14-27-16-6-2-1-3-7-16)18-8-4-5-9-20(18)29-21/h1-13H,14H2