N-[5-tert-butyl-2-(2-chlorophenyl)pyrazol-3-yl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[5-tert-butyl-2-(2-chlorophenyl)pyrazol-3-yl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[5-tert-butyl-2-(2-chlorophenyl)pyrazol-3-yl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[5-tert-butyl-2-(2-chlorophenyl)-3-pyrazolyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[5-tert-butyl-2-(2-chlorophenyl)pyrazol-3-yl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[5-tert-butyl-2-(2-chlorophenyl)pyrazol-3-yl]-piperonylamide Formula: C21H20ClN3O3 MolecularWeight: 397.8548

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H20ClN3O3/c1-21(2,3)18-11-19(25(24-18)15-7-5-4-6-14(15)22)23-20(26)13-8-9-16-17(10-13)28-12-27-16/h4-11H,12H2,1-3H3,(H,23,26)