1-[5,8-bis(oxidanyl)-1,4-bis(oxidanylidene)naphthalen-2-yl]hexyl octanoate

Systemtic Name: 1-[5,8-bis(oxidanyl)-1,4-bis(oxidanylidene)naphthalen-2-yl]hexyl octanoate Openeye Name: 1-(5,8-dihydroxy-1,4-dioxo-2-naphthyl)hexyl octanoate CAS Name: octanoic acid 1-(5,8-dihydroxy-1,4-dioxo-2-naphthalenyl)hexyl ester IUPAC Name: 1-(5,8-dihydroxy-1,4-dioxonaphthalen-2-yl)hexyl octanoate Traditional Name: caprylic acid 1-(5,8-dihydroxy-1,4-diketo-2-naphthyl)hexyl ester Formula: C24H32O6 MolecularWeight: 416.50728

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)OC(CCCCC)C1=CC(=O)C2=C(C=CC(=C2C1=O)O)O

Isomeric SMILES

CCCCCCCC(=O)OC(CCCCC)C1=CC(=O)C2=C(C=CC(=C2C1=O)O)O

InChI

InChI=1S/C24H32O6/c1-3-5-7-8-10-12-21(28)30-20(11-9-6-4-2)16-15-19(27)22-17(25)13-14-18(26)23(22)24(16)29/h13-15,20,25-26H,3-12H2,1-2H3