4-cyanopentanoyl 4-cyanopentaneperoxoate

Systemtic Name: 4-cyanopentanoyl 4-cyanopentaneperoxoate Openeye Name: 4-cyanopentanoyl 4-cyanopentaneperoxoate CAS Name: 4-cyanopentaneperoxoic acid (4-cyano-1-oxopentyl) ester IUPAC Name: 4-cyanopentanoyl 4-cyanopentaneperoxoate Traditional Name: 4-cyanoperoxyvaleric acid 4-cyanopentanoyl ester Formula: C12H16N2O4 MolecularWeight: 252.26644

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC(=O)OOC(=O)CCC(C)C#N)C#N

Isomeric SMILES

CC(CCC(=O)OOC(=O)CCC(C)C#N)C#N

InChI

InChI=1S/C12H16N2O4/c1-9(7-13)3-5-11(15)17-18-12(16)6-4-10(2)8-14/h9-10H,3-6H2,1-2H3