[3-cyano-1-(2-phenyl-1,3-dioxolan-2-yl)heptan-3-yl] ethaneperoxoate

Systemtic Name: [3-cyano-1-(2-phenyl-1,3-dioxolan-2-yl)heptan-3-yl] ethaneperoxoate Openeye Name: [1-cyano-1-[2-(2-phenyl-1,3-dioxolan-2-yl)ethyl]pentyl] peroxyacetate CAS Name: ethaneperoxoic acid [3-cyano-1-(2-phenyl-1,3-dioxolan-2-yl)heptan-3-yl] ester IUPAC Name: [3-cyano-1-(2-phenyl-1,3-dioxolan-2-yl)heptan-3-yl] ethaneperoxoate Traditional Name: peracetic acid [1-cyano-1-[2-(2-phenyl-1,3-dioxolan-2-yl)ethyl]pentyl] ester Formula: C19H25NO5 MolecularWeight: 347.4055

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CCC1(OCCO1)C2=CC=CC=C2)(C#N)OOC(=O)C

Isomeric SMILES

CCCCC(CCC1(OCCO1)C2=CC=CC=C2)(C#N)OOC(=O)C

InChI

InChI=1S/C19H25NO5/c1-3-4-10-18(15-20,25-24-16(2)21)11-12-19(22-13-14-23-19)17-8-6-5-7-9-17/h5-9H,3-4,10-14H2,1-2H3