N-(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)-2-pyrazol-1-yl-ethanamide

Systemtic Name: N-(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)-2-pyrazol-1-yl-ethanamide Openeye Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-2-pyrazol-1-yl-acetamide CAS Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-2-(1-pyrazolyl)acetamide IUPAC Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-2-pyrazol-1-ylacetamide Traditional Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-2-pyrazol-1-yl-acetamide Formula: C13H12BrN3O3 MolecularWeight: 338.15668

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=C(C(=C2)Br)NC(=O)CN3C=CC=N3

Isomeric SMILES

C1COC2=C(O1)C=C(C(=C2)Br)NC(=O)CN3C=CC=N3

InChI

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