N-[2-(1,3-benzodioxol-5-yl)ethyl]-1-tert-butyl-5-ethyl-pyrazole-4-carboxamide

Systemtic Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-1-tert-butyl-5-ethyl-pyrazole-4-carboxamide Openeye Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-1-tert-butyl-5-ethyl-pyrazole-4-carboxamide CAS Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-1-tert-butyl-5-ethyl-4-pyrazolecarboxamide IUPAC Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-1-tert-butyl-5-ethylpyrazole-4-carboxamide Traditional Name: 1-tert-butyl-5-ethyl-N-homopiperonyl-pyrazole-4-carboxamide Formula: C19H25N3O3 MolecularWeight: 343.4201

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=NN1C(C)(C)C)C(=O)NCCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CCC1=C(C=NN1C(C)(C)C)C(=O)NCCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C19H25N3O3/c1-5-15-14(11-21-22(15)19(2,3)4)18(23)20-9-8-13-6-7-16-17(10-13)25-12-24-16/h6-7,10-11H,5,8-9,12H2,1-4H3,(H,20,23)