[4-[2-[oxidanyl(2-piperidin-4-yloxyethanoyl)amino]propanoyl]phenyl] butaneperoxoate

Systemtic Name: [4-[2-[oxidanyl(2-piperidin-4-yloxyethanoyl)amino]propanoyl]phenyl] butaneperoxoate Openeye Name: [4-[2-[hydroxy-[2-(4-piperidyloxy)acetyl]amino]propanoyl]phenyl] butaneperoxoate CAS Name: butaneperoxoic acid [4-[2-[hydroxy-[1-oxo-2-(4-piperidinyloxy)ethyl]amino]-1-oxopropyl]phenyl] ester IUPAC Name: [4-[2-[hydroxy-(2-piperidin-4-yloxyacetyl)amino]propanoyl]phenyl] butaneperoxoate Traditional Name: peroxybutyric acid [4-[2-[hydroxy-[2-(4-piperidyloxy)acetyl]amino]propanoyl]phenyl] ester Formula: C20H28N2O7 MolecularWeight: 408.44552

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OOC1=CC=C(C=C1)C(=O)C(C)N(C(=O)COC2CCNCC2)O

Isomeric SMILES

CCCC(=O)OOC1=CC=C(C=C1)C(=O)C(C)N(C(=O)COC2CCNCC2)O

InChI

InChI=1S/C20H28N2O7/c1-3-4-19(24)29-28-17-7-5-15(6-8-17)20(25)14(2)22(26)18(23)13-27-16-9-11-21-12-10-16/h5-8,14,16,21,26H,3-4,9-13H2,1-2H3