(2-tert-butyl-4-nitro-phenyl) ethaneperoxoate

Systemtic Name: (2-tert-butyl-4-nitro-phenyl) ethaneperoxoate Openeye Name: (2-tert-butyl-4-nitro-phenyl) peroxyacetate CAS Name: ethaneperoxoic acid (2-tert-butyl-4-nitrophenyl) ester IUPAC Name: (2-tert-butyl-4-nitrophenyl) ethaneperoxoate Traditional Name: peracetic acid (2-tert-butyl-4-nitro-phenyl) ester Formula: C12H15NO5 MolecularWeight: 253.2512

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OOC1=C(C=C(C=C1)[N+](=O)[O-])C(C)(C)C

Isomeric SMILES

CC(=O)OOC1=C(C=C(C=C1)[N+](=O)[O-])C(C)(C)C

InChI

InChI=1S/C12H15NO5/c1-8(14)17-18-11-6-5-9(13(15)16)7-10(11)12(2,3)4/h5-7H,1-4H3