(3-ethoxycarbonyl-2-phenyl-1-benzofuran-5-yl) 2,5-diphenylpyrazole-3-carboxylate

Systemtic Name: (3-ethoxycarbonyl-2-phenyl-1-benzofuran-5-yl) 2,5-diphenylpyrazole-3-carboxylate Openeye Name: (3-ethoxycarbonyl-2-phenyl-benzofuran-5-yl) 2,5-diphenylpyrazole-3-carboxylate CAS Name: 2,5-diphenyl-3-pyrazolecarboxylic acid (3-ethoxycarbonyl-2-phenyl-5-benzofuranyl) ester IUPAC Name: (3-ethoxycarbonyl-2-phenyl-1-benzofuran-5-yl) 2,5-diphenylpyrazole-3-carboxylate Traditional Name: 2,5-diphenylpyrazole-3-carboxylic acid (3-carbethoxy-2-phenyl-benzofuran-5-yl) ester Formula: C33H24N2O5 MolecularWeight: 528.55406

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC2=C1C=C(C=C2)OC(=O)C3=CC(=NN3C4=CC=CC=C4)C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

CCOC(=O)C1=C(OC2=C1C=C(C=C2)OC(=O)C3=CC(=NN3C4=CC=CC=C4)C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C33H24N2O5/c1-2-38-33(37)30-26-20-25(18-19-29(26)40-31(30)23-14-8-4-9-15-23)39-32(36)28-21-27(22-12-6-3-7-13-22)34-35(28)24-16-10-5-11-17-24/h3-21H,2H2,1H3