2-ethoxycarbonyl-2-ethyl-4-(3-ethylpyridin-4-yl)-4-oxidanylidene-butaneperoxoic acid

Systemtic Name: 2-ethoxycarbonyl-2-ethyl-4-(3-ethylpyridin-4-yl)-4-oxidanylidene-butaneperoxoic acid Openeye Name: 2-ethoxycarbonyl-2-ethyl-4-(3-ethyl-4-pyridyl)-4-oxo-butaneperoxoic acid CAS Name: 2-ethoxycarbonyl-2-ethyl-4-(3-ethyl-4-pyridinyl)-4-oxobutaneperoxoic acid IUPAC Name: 2-ethoxycarbonyl-2-ethyl-4-(3-ethylpyridin-4-yl)-4-oxobutaneperoxoic acid Traditional Name: 2-carbethoxy-2-ethyl-4-(3-ethyl-4-pyridyl)-4-keto-peroxybutyric acid Formula: C16H21NO6 MolecularWeight: 323.34104

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CN=C1)C(=O)CC(CC)(C(=O)OCC)C(=O)OO

Isomeric SMILES

CCC1=C(C=CN=C1)C(=O)CC(CC)(C(=O)OCC)C(=O)OO

InChI

InChI=1S/C16H21NO6/c1-4-11-10-17-8-7-12(11)13(18)9-16(5-2,15(20)23-21)14(19)22-6-3/h7-8,10,21H,4-6,9H2,1-3H3