phenyl 3-oxidanylidene-2-[2-[3-(pyridin-3-ylmethoxy)phenyl]ethyl]butaneperoxoate

Systemtic Name: phenyl 3-oxidanylidene-2-[2-[3-(pyridin-3-ylmethoxy)phenyl]ethyl]butaneperoxoate Openeye Name: phenyl 3-oxo-2-[2-[3-(3-pyridylmethoxy)phenyl]ethyl]butaneperoxoate CAS Name: 3-oxo-2-[2-[3-(3-pyridinylmethoxy)phenyl]ethyl]butaneperoxoic acid phenyl ester IUPAC Name: phenyl 3-oxo-2-[2-[3-(pyridin-3-ylmethoxy)phenyl]ethyl]butaneperoxoate Traditional Name: 3-keto-2-[2-[3-(3-pyridylmethoxy)phenyl]ethyl]peroxybutyric acid phenyl ester Formula: C24H23NO5 MolecularWeight: 405.44312

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(CCC1=CC(=CC=C1)OCC2=CN=CC=C2)C(=O)OOC3=CC=CC=C3

Isomeric SMILES

CC(=O)C(CCC1=CC(=CC=C1)OCC2=CN=CC=C2)C(=O)OOC3=CC=CC=C3

InChI

InChI=1S/C24H23NO5/c1-18(26)23(24(27)30-29-21-9-3-2-4-10-21)13-12-19-7-5-11-22(15-19)28-17-20-8-6-14-25-16-20/h2-11,14-16,23H,12-13,17H2,1H3