1-(6-oxidanylidene-6-phenyl-hexoxy)ethyl 3-hexyl-6-[8-oxidanylidene-8-[1-(6-oxidanylidene-6-phenyl-hexoxy)ethoxy]octyl]cyclohex-3-ene-1-carboxylate

Systemtic Name: 1-(6-oxidanylidene-6-phenyl-hexoxy)ethyl 3-hexyl-6-[8-oxidanylidene-8-[1-(6-oxidanylidene-6-phenyl-hexoxy)ethoxy]octyl]cyclohex-3-ene-1-carboxylate Openeye Name: 1-(6-oxo-6-phenyl-hexoxy)ethyl 3-hexyl-6-[8-oxo-8-[1-(6-oxo-6-phenyl-hexoxy)ethoxy]octyl]cyclohex-3-ene-1-carboxylate CAS Name: 3-hexyl-6-[8-oxo-8-[1-(6-oxo-6-phenylhexoxy)ethoxy]octyl]-1-cyclohex-3-enecarboxylic acid 1-(6-oxo-6-phenylhexoxy)ethyl ester IUPAC Name: 1-(6-oxo-6-phenylhexoxy)ethyl 3-hexyl-6-[8-oxo-8-[1-(6-oxo-6-phenylhexoxy)ethoxy]octyl]cyclohex-3-ene-1-carboxylate Traditional Name: 3-hexyl-6-[8-keto-8-[1-(6-keto-6-phenyl-hexoxy)ethoxy]octyl]cyclohex-3-ene-1-carboxylic acid 1-(6-keto-6-phenyl-hexoxy)ethyl ester Formula: C49H72O8 MolecularWeight: 789.09118

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CCC(C(C1)C(=O)OC(C)OCCCCCC(=O)C2=CC=CC=C2)CCCCCCCC(=O)OC(C)OCCCCCC(=O)C3=CC=CC=C3

Isomeric SMILES

CCCCCCC1=CCC(C(C1)C(=O)OC(C)OCCCCCC(=O)C2=CC=CC=C2)CCCCCCCC(=O)OC(C)OCCCCCC(=O)C3=CC=CC=C3

InChI

InChI=1S/C49H72O8/c1-4-5-6-14-25-41-34-35-42(45(38-41)49(53)57-40(3)55-37-24-13-21-32-47(51)44-29-18-11-19-30-44)26-15-8-7-9-22-33-48(52)56-39(2)54-36-23-12-20-31-46(50)43-27-16-10-17-28-43/h10-11,16-19,27-30,34,39-40,42,45H,4-9,12-15,20-26,31-33,35-38H2,1-3H3