N-(1,3-benzodioxol-5-yl)-3-(4-bromanylpyrazol-1-yl)propanamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-3-(4-bromanylpyrazol-1-yl)propanamide Openeye Name: N-(1,3-benzodioxol-5-yl)-3-(4-bromopyrazol-1-yl)propanamide CAS Name: N-(1,3-benzodioxol-5-yl)-3-(4-bromo-1-pyrazolyl)propanamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-3-(4-bromopyrazol-1-yl)propanamide Traditional Name: N-(1,3-benzodioxol-5-yl)-3-(4-bromopyrazol-1-yl)propionamide Formula: C13H12BrN3O3 MolecularWeight: 338.15668

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)NC(=O)CCN3C=C(C=N3)Br

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)NC(=O)CCN3C=C(C=N3)Br

InChI

InChI=1S/C13H12BrN3O3/c14-9-6-15-17(7-9)4-3-13(18)16-10-1-2-11-12(5-10)20-8-19-11/h1-2,5-7H,3-4,8H2,(H,16,18)