phenyl 2,2-dimethyl-3-[1-(pyridin-3-ylmethoxy)pentoxy]hexaneperoxoate

Systemtic Name: phenyl 2,2-dimethyl-3-[1-(pyridin-3-ylmethoxy)pentoxy]hexaneperoxoate Openeye Name: phenyl 2,2-dimethyl-3-[1-(3-pyridylmethoxy)pentoxy]hexaneperoxoate CAS Name: 2,2-dimethyl-3-[1-(3-pyridinylmethoxy)pentoxy]hexaneperoxoic acid phenyl ester IUPAC Name: phenyl 2,2-dimethyl-3-[1-(pyridin-3-ylmethoxy)pentoxy]hexaneperoxoate Traditional Name: 2,2-dimethyl-3-[1-(3-pyridylmethoxy)pentoxy]hexaneperoxoic acid phenyl ester Formula: C25H35NO5 MolecularWeight: 429.5491

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(OCC1=CN=CC=C1)OC(CCC)C(C)(C)C(=O)OOC2=CC=CC=C2

Isomeric SMILES

CCCCC(OCC1=CN=CC=C1)OC(CCC)C(C)(C)C(=O)OOC2=CC=CC=C2

InChI

InChI=1S/C25H35NO5/c1-5-7-16-23(28-19-20-13-11-17-26-18-20)29-22(12-6-2)25(3,4)24(27)31-30-21-14-9-8-10-15-21/h8-11,13-15,17-18,22-23H,5-7,12,16,19H2,1-4H3