(3-propan-2-ylphenyl) 2-[(5-cyano-2-methoxy-phenyl)sulfonylamino]-2-ethyl-butaneperoxoate

Systemtic Name: (3-propan-2-ylphenyl) 2-[(5-cyano-2-methoxy-phenyl)sulfonylamino]-2-ethyl-butaneperoxoate Openeye Name: (3-isopropylphenyl) 2-[(5-cyano-2-methoxy-phenyl)sulfonylamino]-2-ethyl-butaneperoxoate CAS Name: 2-[(5-cyano-2-methoxyphenyl)sulfonylamino]-2-ethylbutaneperoxoic acid (3-propan-2-ylphenyl) ester IUPAC Name: (3-propan-2-ylphenyl) 2-[(5-cyano-2-methoxyphenyl)sulfonylamino]-2-ethylbutaneperoxoate Traditional Name: 2-[(5-cyano-2-methoxy-phenyl)sulfonylamino]-2-ethyl-peroxybutyric acid m-cumenyl ester Formula: C23H28N2O6S MolecularWeight: 460.54322

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(C(=O)OOC1=CC=CC(=C1)C(C)C)NS(=O)(=O)C2=C(C=CC(=C2)C#N)OC

Isomeric SMILES

CCC(CC)(C(=O)OOC1=CC=CC(=C1)C(C)C)NS(=O)(=O)C2=C(C=CC(=C2)C#N)OC

InChI

InChI=1S/C23H28N2O6S/c1-6-23(7-2,22(26)31-30-19-10-8-9-18(14-19)16(3)4)25-32(27,28)21-13-17(15-24)11-12-20(21)29-5/h8-14,16,25H,6-7H2,1-5H3