1,3-benzodioxol-5-ylmethyl 3-(4-fluorophenyl)-1-phenyl-pyrazole-4-carboxylate

Systemtic Name: 1,3-benzodioxol-5-ylmethyl 3-(4-fluorophenyl)-1-phenyl-pyrazole-4-carboxylate Openeye Name: 1,3-benzodioxol-5-ylmethyl 3-(4-fluorophenyl)-1-phenyl-pyrazole-4-carboxylate CAS Name: 3-(4-fluorophenyl)-1-phenyl-4-pyrazolecarboxylic acid 1,3-benzodioxol-5-ylmethyl ester IUPAC Name: 1,3-benzodioxol-5-ylmethyl 3-(4-fluorophenyl)-1-phenylpyrazole-4-carboxylate Traditional Name: 3-(4-fluorophenyl)-1-phenyl-pyrazole-4-carboxylic acid piperonyl ester Formula: C24H17FN2O4 MolecularWeight: 416.401183

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)COC(=O)C3=CN(N=C3C4=CC=C(C=C4)F)C5=CC=CC=C5

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)COC(=O)C3=CN(N=C3C4=CC=C(C=C4)F)C5=CC=CC=C5

InChI

InChI=1S/C24H17FN2O4/c25-18-9-7-17(8-10-18)23-20(13-27(26-23)19-4-2-1-3-5-19)24(28)29-14-16-6-11-21-22(12-16)31-15-30-21/h1-13H,14-15H2