ethyl 4-benzo[e][1]benzofuran-2-ylcarbonyl-1-phenyl-pyrazole-3-carboxylate

Systemtic Name: ethyl 4-benzo[e][1]benzofuran-2-ylcarbonyl-1-phenyl-pyrazole-3-carboxylate Openeye Name: ethyl 4-(benzo[e]benzofuran-2-carbonyl)-1-phenyl-pyrazole-3-carboxylate CAS Name: 4-[2-benzo[e]benzofuranyl(oxo)methyl]-1-phenyl-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(benzo[e][1]benzofuran-2-carbonyl)-1-phenylpyrazole-3-carboxylate Traditional Name: 4-(benzo[e]benzofuran-2-carbonyl)-1-phenyl-pyrazole-3-carboxylic acid ethyl ester Formula: C25H18N2O4 MolecularWeight: 410.42142

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C=C1C(=O)C2=CC3=C(O2)C=CC4=CC=CC=C43)C5=CC=CC=C5

Isomeric SMILES

CCOC(=O)C1=NN(C=C1C(=O)C2=CC3=C(O2)C=CC4=CC=CC=C43)C5=CC=CC=C5

InChI

InChI=1S/C25H18N2O4/c1-2-30-25(29)23-20(15-27(26-23)17-9-4-3-5-10-17)24(28)22-14-19-18-11-7-6-8-16(18)12-13-21(19)31-22/h3-15H,2H2,1H3