ethyl 1-(3,4-dimethylphenyl)-4-ethanoyl-pyrazole-3-carboxylate

Systemtic Name: ethyl 1-(3,4-dimethylphenyl)-4-ethanoyl-pyrazole-3-carboxylate Openeye Name: ethyl 4-acetyl-1-(3,4-dimethylphenyl)pyrazole-3-carboxylate CAS Name: 4-acetyl-1-(3,4-dimethylphenyl)-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-acetyl-1-(3,4-dimethylphenyl)pyrazole-3-carboxylate Traditional Name: 4-acetyl-1-(3,4-dimethylphenyl)pyrazole-3-carboxylic acid ethyl ester Formula: C16H18N2O3 MolecularWeight: 286.32572

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C=C1C(=O)C)C2=CC(=C(C=C2)C)C

Isomeric SMILES

CCOC(=O)C1=NN(C=C1C(=O)C)C2=CC(=C(C=C2)C)C

InChI

InChI=1S/C16H18N2O3/c1-5-21-16(20)15-14(12(4)19)9-18(17-15)13-7-6-10(2)11(3)8-13/h6-9H,5H2,1-4H3