5-[(4-oxidanylidene-8-propyl-2,3-dihydrochromen-7-yl)oxy]pentyl 3-[3-(1-oxidanylideneisochromen-3-yl)phenyl]propaneperoxoate

Systemtic Name: 5-[(4-oxidanylidene-8-propyl-2,3-dihydrochromen-7-yl)oxy]pentyl 3-[3-(1-oxidanylideneisochromen-3-yl)phenyl]propaneperoxoate Openeye Name: 5-(4-oxo-8-propyl-chroman-7-yl)oxypentyl 3-[3-(1-oxoisochromen-3-yl)phenyl]propaneperoxoate CAS Name: 3-[3-(1-oxo-2-benzopyran-3-yl)phenyl]propaneperoxoic acid 5-[(4-oxo-8-propyl-3,4-dihydro-2H-1-benzopyran-7-yl)oxy]pentyl ester IUPAC Name: 5-[(4-oxo-8-propyl-2,3-dihydrochromen-7-yl)oxy]pentyl 3-[3-(1-oxoisochromen-3-yl)phenyl]propaneperoxoate Traditional Name: 3-[3-(1-ketoisochromen-3-yl)phenyl]peroxypropionic acid 5-(4-keto-8-propyl-chroman-7-yl)oxypentyl ester Formula: C35H36O8 MolecularWeight: 584.65554

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC2=C1OCCC2=O)OCCCCCOOC(=O)CCC3=CC=CC(=C3)C4=CC5=CC=CC=C5C(=O)O4

Isomeric SMILES

CCCC1=C(C=CC2=C1OCCC2=O)OCCCCCOOC(=O)CCC3=CC=CC(=C3)C4=CC5=CC=CC=C5C(=O)O4

InChI

InChI=1S/C35H36O8/c1-2-9-29-31(16-15-28-30(36)18-21-40-34(28)29)39-19-6-3-7-20-41-43-33(37)17-14-24-10-8-12-26(22-24)32-23-25-11-4-5-13-27(25)35(38)42-32/h4-5,8,10-13,15-16,22-23H,2-3,6-7,9,14,17-21H2,1H3