[4-[3-oxidanyl-2-(2-piperidin-4-yloxyethanoylamino)propanoyl]phenyl] butaneperoxoate

Systemtic Name: [4-[3-oxidanyl-2-(2-piperidin-4-yloxyethanoylamino)propanoyl]phenyl] butaneperoxoate Openeye Name: [4-[3-hydroxy-2-[[2-(4-piperidyloxy)acetyl]amino]propanoyl]phenyl] butaneperoxoate CAS Name: butaneperoxoic acid [4-[3-hydroxy-1-oxo-2-[[1-oxo-2-(4-piperidinyloxy)ethyl]amino]propyl]phenyl] ester IUPAC Name: [4-[3-hydroxy-2-[(2-piperidin-4-yloxyacetyl)amino]propanoyl]phenyl] butaneperoxoate Traditional Name: peroxybutyric acid [4-[3-hydroxy-2-[[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(CO)NC(=O)COC2CCNCC2

Isomeric SMILES

CCCC(=O)OOC1=CC=C(C=C1)C(=O)C(CO)NC(=O)COC2CCNCC2

InChI

InChI=1S/C20H28N2O7/c1-2-3-19(25)29-28-16-6-4-14(5-7-16)20(26)17(12-23)22-18(24)13-27-15-8-10-21-11-9-15/h4-7,15,17,21,23H,2-3,8-13H2,1H3,(H,22,24)