(2,3,6-trimethylphenyl) 4-methoxy-1-phenyl-pyrazole-3-carboxylate

Systemtic Name: (2,3,6-trimethylphenyl) 4-methoxy-1-phenyl-pyrazole-3-carboxylate Openeye Name: (2,3,6-trimethylphenyl) 4-methoxy-1-phenyl-pyrazole-3-carboxylate CAS Name: 4-methoxy-1-phenyl-3-pyrazolecarboxylic acid (2,3,6-trimethylphenyl) ester IUPAC Name: (2,3,6-trimethylphenyl) 4-methoxy-1-phenylpyrazole-3-carboxylate Traditional Name: 4-methoxy-1-phenyl-pyrazole-3-carboxylic acid (2,3,6-trimethylphenyl) ester Formula: C20H20N2O3 MolecularWeight: 336.3844

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)C)OC(=O)C2=NN(C=C2OC)C3=CC=CC=C3)C

Isomeric SMILES

CC1=C(C(=C(C=C1)C)OC(=O)C2=NN(C=C2OC)C3=CC=CC=C3)C

InChI

InChI=1S/C20H20N2O3/c1-13-10-11-14(2)19(15(13)3)25-20(23)18-17(24-4)12-22(21-18)16-8-6-5-7-9-16/h5-12H,1-4H3