[2-cyano-4-[methyl(phenylmethoxycarbonyl)amino]phenyl] 3,3-dimethylbutaneperoxoate

Systemtic Name: [2-cyano-4-[methyl(phenylmethoxycarbonyl)amino]phenyl] 3,3-dimethylbutaneperoxoate Openeye Name: [4-[benzyloxycarbonyl(methyl)amino]-2-cyano-phenyl] 3,3-dimethylbutaneperoxoate CAS Name: 3,3-dimethylbutaneperoxoic acid [2-cyano-4-[methyl(phenylmethoxycarbonyl)amino]phenyl] ester IUPAC Name: [2-cyano-4-[methyl(phenylmethoxycarbonyl)amino]phenyl] 3,3-dimethylbutaneperoxoate Traditional Name: 3,3-dimethylperoxybutyric acid [4-[carbobenzoxy(methyl)amino]-2-cyano-phenyl] ester Formula: C22H24N2O5 MolecularWeight: 396.43636

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(=O)OOC1=C(C=C(C=C1)N(C)C(=O)OCC2=CC=CC=C2)C#N

Isomeric SMILES

CC(C)(C)CC(=O)OOC1=C(C=C(C=C1)N(C)C(=O)OCC2=CC=CC=C2)C#N

InChI

InChI=1S/C22H24N2O5/c1-22(2,3)13-20(25)29-28-19-11-10-18(12-17(19)14-23)24(4)21(26)27-15-16-8-6-5-7-9-16/h5-12H,13,15H2,1-4H3