ethyl 1-(4-chlorophenyl)-4-methanoyl-pyrazole-3-carboxylate

Systemtic Name: ethyl 1-(4-chlorophenyl)-4-methanoyl-pyrazole-3-carboxylate Openeye Name: ethyl 1-(4-chlorophenyl)-4-formyl-pyrazole-3-carboxylate CAS Name: 1-(4-chlorophenyl)-4-formyl-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(4-chlorophenyl)-4-formylpyrazole-3-carboxylate Traditional Name: 1-(4-chlorophenyl)-4-formyl-pyrazole-3-carboxylic acid ethyl ester Formula: C13H11ClN2O3 MolecularWeight: 278.69104

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H11ClN2O3/c1-2-19-13(18)12-9(8-17)7-16(15-12)11-5-3-10(14)4-6-11/h3-8H,2H2,1H3