(5-chloranylquinolin-8-yl) 3-methyloctaneperoxoate

Systemtic Name: (5-chloranylquinolin-8-yl) 3-methyloctaneperoxoate Openeye Name: (5-chloro-8-quinolyl) 3-methyloctaneperoxoate CAS Name: 3-methyloctaneperoxoic acid (5-chloro-8-quinolinyl) ester IUPAC Name: (5-chloroquinolin-8-yl) 3-methyloctaneperoxoate Traditional Name: 3-methylperoxycaprylic acid (5-chloro-8-quinolyl) ester Formula: C18H22ClNO3 MolecularWeight: 335.82518

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)CC(=O)OOC1=C2C(=C(C=C1)Cl)C=CC=N2

Isomeric SMILES

CCCCCC(C)CC(=O)OOC1=C2C(=C(C=C1)Cl)C=CC=N2

InChI

InChI=1S/C18H22ClNO3/c1-3-4-5-7-13(2)12-17(21)23-22-16-10-9-15(19)14-8-6-11-20-18(14)16/h6,8-11,13H,3-5,7,12H2,1-2H3