[2-(2-chlorophenyl)-5-propan-2-yl-pyrazol-3-yl] 1,3-benzodioxole-5-carboxylate

Systemtic Name: [2-(2-chlorophenyl)-5-propan-2-yl-pyrazol-3-yl] 1,3-benzodioxole-5-carboxylate Openeye Name: [2-(2-chlorophenyl)-5-isopropyl-pyrazol-3-yl] 1,3-benzodioxole-5-carboxylate CAS Name: 1,3-benzodioxole-5-carboxylic acid [2-(2-chlorophenyl)-5-propan-2-yl-3-pyrazolyl] ester IUPAC Name: [2-(2-chlorophenyl)-5-propan-2-ylpyrazol-3-yl] 1,3-benzodioxole-5-carboxylate Traditional Name: piperonylic acid [2-(2-chlorophenyl)-5-isopropyl-pyrazol-3-yl] ester Formula: C20H17ClN2O4 MolecularWeight: 384.81298

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NN(C(=C1)OC(=O)C2=CC3=C(C=C2)OCO3)C4=CC=CC=C4Cl

Isomeric SMILES

CC(C)C1=NN(C(=C1)OC(=O)C2=CC3=C(C=C2)OCO3)C4=CC=CC=C4Cl

InChI

InChI=1S/C20H17ClN2O4/c1-12(2)15-10-19(23(22-15)16-6-4-3-5-14(16)21)27-20(24)13-7-8-17-18(9-13)26-11-25-17/h3-10,12H,11H2,1-2H3