2-[bis(oxidanyl)methylidene]-N-(5-bromanylpyridin-2-yl)-3-oxidanylidene-pentanenitrilium

Systemtic Name: 2-[bis(oxidanyl)methylidene]-N-(5-bromanylpyridin-2-yl)-3-oxidanylidene-pentanenitrilium Openeye Name: N-(5-bromo-2-pyridyl)-2-(dihydroxymethylene)-3-oxo-pentanenitrilium CAS Name: N-(5-bromo-2-pyridinyl)-2-(dihydroxymethylidene)-3-oxopentanenitrilium IUPAC Name: N-(5-bromopyridin-2-yl)-2-(dihydroxymethylidene)-3-oxopentanenitrilium Traditional Name: N-(5-bromo-2-pyridyl)-3,3-dihydroxy-2-propionyl-acrylonitrilium Formula: C11H10BrN2O3+ MolecularWeight: 298.1127

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C(=C(O)O)C#[N+]C1=NC=C(C=C1)Br

Isomeric SMILES

CCC(=O)C(=C(O)O)C#[N+]C1=NC=C(C=C1)Br

InChI

InChI=1S/C11H9BrN2O3/c1-2-9(15)8(11(16)17)6-14-10-4-3-7(12)5-13-10/h3-5H,2H2,1H3,(H,16,17)/p+1