N-[3-(4-tert-butylphenyl)-5-ethyl-1H-pyrazol-4-yl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[3-(4-tert-butylphenyl)-5-ethyl-1H-pyrazol-4-yl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[3-(4-tert-butylphenyl)-5-ethyl-1H-pyrazol-4-yl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[3-(4-tert-butylphenyl)-5-ethyl-1H-pyrazol-4-yl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[3-(4-tert-butylphenyl)-5-ethyl-1H-pyrazol-4-yl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[3-(4-tert-butylphenyl)-5-ethyl-1H-pyrazol-4-yl]-piperonylamide Formula: C23H25N3O3 MolecularWeight: 391.4629

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NN1)C2=CC=C(C=C2)C(C)(C)C)NC(=O)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCC1=C(C(=NN1)C2=CC=C(C=C2)C(C)(C)C)NC(=O)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C23H25N3O3/c1-5-17-21(24-22(27)15-8-11-18-19(12-15)29-13-28-18)20(26-25-17)14-6-9-16(10-7-14)23(2,3)4/h6-12H,5,13H2,1-4H3,(H,24,27)(H,25,26)