(5-ethanoyl-2-ethoxy-phenyl)methyl 3-phenyl-1H-pyrazole-5-carboxylate

Systemtic Name: (5-ethanoyl-2-ethoxy-phenyl)methyl 3-phenyl-1H-pyrazole-5-carboxylate Openeye Name: (5-acetyl-2-ethoxy-phenyl)methyl 3-phenyl-1H-pyrazole-5-carboxylate CAS Name: 3-phenyl-1H-pyrazole-5-carboxylic acid (5-acetyl-2-ethoxyphenyl)methyl ester IUPAC Name: (5-acetyl-2-ethoxyphenyl)methyl 3-phenyl-1H-pyrazole-5-carboxylate Traditional Name: 3-phenyl-1H-pyrazole-5-carboxylic acid (5-acetyl-2-ethoxy-benzyl) ester Formula: C21H20N2O4 MolecularWeight: 364.3945

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)C)COC(=O)C2=CC(=NN2)C3=CC=CC=C3

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)C)COC(=O)C2=CC(=NN2)C3=CC=CC=C3

InChI

InChI=1S/C21H20N2O4/c1-3-26-20-10-9-16(14(2)24)11-17(20)13-27-21(25)19-12-18(22-23-19)15-7-5-4-6-8-15/h4-12H,3,13H2,1-2H3,(H,22,23)