2-ethoxycarbonyl-2-ethyl-4-oxidanylidene-4-pyridin-4-yl-butaneperoxoic acid

Systemtic Name: 2-ethoxycarbonyl-2-ethyl-4-oxidanylidene-4-pyridin-4-yl-butaneperoxoic acid Openeye Name: 2-ethoxycarbonyl-2-ethyl-4-oxo-4-(4-pyridyl)butaneperoxoic acid CAS Name: 2-ethoxycarbonyl-2-ethyl-4-oxo-4-pyridin-4-ylbutaneperoxoic acid IUPAC Name: 2-ethoxycarbonyl-2-ethyl-4-oxo-4-pyridin-4-ylbutaneperoxoic acid Traditional Name: 2-carbethoxy-2-ethyl-4-keto-4-(4-pyridyl)peroxybutyric acid Formula: C14H17NO6 MolecularWeight: 295.28788

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC(=O)C1=CC=NC=C1)(C(=O)OCC)C(=O)OO

Isomeric SMILES

CCC(CC(=O)C1=CC=NC=C1)(C(=O)OCC)C(=O)OO

InChI

InChI=1S/C14H17NO6/c1-3-14(13(18)21-19,12(17)20-4-2)9-11(16)10-5-7-15-8-6-10/h5-8,19H,3-4,9H2,1-2H3