(4-ethanoylphenyl) 1-[(2-chlorophenyl)methyl]-3,5-dimethyl-pyrazole-4-carboxylate

Systemtic Name: (4-ethanoylphenyl) 1-[(2-chlorophenyl)methyl]-3,5-dimethyl-pyrazole-4-carboxylate Openeye Name: (4-acetylphenyl) 1-[(2-chlorophenyl)methyl]-3,5-dimethyl-pyrazole-4-carboxylate CAS Name: 1-[(2-chlorophenyl)methyl]-3,5-dimethyl-4-pyrazolecarboxylic acid (4-acetylphenyl) ester IUPAC Name: (4-acetylphenyl) 1-[(2-chlorophenyl)methyl]-3,5-dimethylpyrazole-4-carboxylate Traditional Name: 1-(2-chlorobenzyl)-3,5-dimethyl-pyrazole-4-carboxylic acid (4-acetylphenyl) ester Formula: C21H19ClN2O3 MolecularWeight: 382.84016

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=CC=C2Cl)C)C(=O)OC3=CC=C(C=C3)C(=O)C

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=CC=C2Cl)C)C(=O)OC3=CC=C(C=C3)C(=O)C

InChI

InChI=1S/C21H19ClN2O3/c1-13-20(21(26)27-18-10-8-16(9-11-18)15(3)25)14(2)24(23-13)12-17-6-4-5-7-19(17)22/h4-11H,12H2,1-3H3