[2-(3,4-dichlorophenyl)-5-propan-2-yl-pyrazol-3-yl] 1,3-benzodioxole-5-carboxylate

Systemtic Name: [2-(3,4-dichlorophenyl)-5-propan-2-yl-pyrazol-3-yl] 1,3-benzodioxole-5-carboxylate Openeye Name: [2-(3,4-dichlorophenyl)-5-isopropyl-pyrazol-3-yl] 1,3-benzodioxole-5-carboxylate CAS Name: 1,3-benzodioxole-5-carboxylic acid [2-(3,4-dichlorophenyl)-5-propan-2-yl-3-pyrazolyl] ester IUPAC Name: [2-(3,4-dichlorophenyl)-5-propan-2-ylpyrazol-3-yl] 1,3-benzodioxole-5-carboxylate Traditional Name: piperonylic acid [2-(3,4-dichlorophenyl)-5-isopropyl-pyrazol-3-yl] ester Formula: C20H16Cl2N2O4 MolecularWeight: 419.25804

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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(=C(C=C4)Cl)Cl

Isomeric SMILES

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

InChI

InChI=1S/C20H16Cl2N2O4/c1-11(2)16-9-19(24(23-16)13-4-5-14(21)15(22)8-13)28-20(25)12-3-6-17-18(7-12)27-10-26-17/h3-9,11H,10H2,1-2H3