N-(1,3-benzodioxol-5-yl)-4-bromanyl-1-ethyl-pyrazole-3-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-4-bromanyl-1-ethyl-pyrazole-3-carboxamide Openeye Name: N-(1,3-benzodioxol-5-yl)-4-bromo-1-ethyl-pyrazole-3-carboxamide CAS Name: N-(1,3-benzodioxol-5-yl)-4-bromo-1-ethyl-3-pyrazolecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-4-bromo-1-ethylpyrazole-3-carboxamide Traditional Name: N-(1,3-benzodioxol-5-yl)-4-bromo-1-ethyl-pyrazole-3-carboxamide Formula: C13H12BrN3O3 MolecularWeight: 338.15668

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C(=O)NC2=CC3=C(C=C2)OCO3)Br

Isomeric SMILES

CCN1C=C(C(=N1)C(=O)NC2=CC3=C(C=C2)OCO3)Br

InChI

InChI=1S/C13H12BrN3O3/c1-2-17-6-9(14)12(16-17)13(18)15-8-3-4-10-11(5-8)20-7-19-10/h3-6H,2,7H2,1H3,(H,15,18)