1-(1,3-benzodioxol-5-yl)-2-bromanyl-2-pyridin-3-yl-ethanone hydrobromide

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-2-bromanyl-2-pyridin-3-yl-ethanone hydrobromide Openeye Name: 1-(1,3-benzodioxol-5-yl)-2-bromo-2-(3-pyridyl)ethanone hydrobromide CAS Name: 1-(1,3-benzodioxol-5-yl)-2-bromo-2-(3-pyridinyl)ethanone hydrobromide IUPAC Name: 1-(1,3-benzodioxol-5-yl)-2-bromo-2-pyridin-3-ylethanone hydrobromide Traditional Name: 1-(1,3-benzodioxol-5-yl)-2-bromo-2-(3-pyridyl)ethanone hydrobromide Formula: C14H11Br2NO3 MolecularWeight: 401.05004

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(=O)C(C3=CN=CC=C3)Br.Br

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(=O)C(C3=CN=CC=C3)Br.Br

InChI

InChI=1S/C14H10BrNO3.BrH/c15-13(10-2-1-5-16-7-10)14(17)9-3-4-11-12(6-9)19-8-18-11;/h1-7,13H,8H2;1H