2-phenylmethoxyethyl 5-[2-methoxy-4-[2-methyl-6-oxidanylidene-6-(2-phenylmethoxyethoxy)hexan-2-yl]-5-oxidanyl-phenyl]-5-methyl-hexanoate

Systemtic Name: 2-phenylmethoxyethyl 5-[2-methoxy-4-[2-methyl-6-oxidanylidene-6-(2-phenylmethoxyethoxy)hexan-2-yl]-5-oxidanyl-phenyl]-5-methyl-hexanoate Openeye Name: 2-benzyloxyethyl 5-[4-[5-(2-benzyloxyethoxy)-1,1-dimethyl-5-oxo-pentyl]-5-hydroxy-2-methoxy-phenyl]-5-methyl-hexanoate CAS Name: 5-[5-hydroxy-2-methoxy-4-[2-methyl-6-oxo-6-(2-phenylmethoxyethoxy)hexan-2-yl]phenyl]-5-methylhexanoic acid 2-phenylmethoxyethyl ester IUPAC Name: 2-phenylmethoxyethyl 5-[5-hydroxy-2-methoxy-4-[2-methyl-6-oxo-6-(2-phenylmethoxyethoxy)hexan-2-yl]phenyl]-5-methylhexanoate Traditional Name: 5-[4-[5-(2-benzoxyethoxy)-5-keto-1,1-dimethyl-pentyl]-5-hydroxy-2-methoxy-phenyl]-5-methyl-hexanoic acid 2-benzoxyethyl ester Formula: C39H52O8 MolecularWeight: 648.82538

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCCC(=O)OCCOCC1=CC=CC=C1)C2=CC(=C(C=C2OC)C(C)(C)CCCC(=O)OCCOCC3=CC=CC=C3)O

Isomeric SMILES

CC(C)(CCCC(=O)OCCOCC1=CC=CC=C1)C2=CC(=C(C=C2OC)C(C)(C)CCCC(=O)OCCOCC3=CC=CC=C3)O

InChI

InChI=1S/C39H52O8/c1-38(2,20-12-18-36(41)46-24-22-44-28-30-14-8-6-9-15-30)32-27-35(43-5)33(26-34(32)40)39(3,4)21-13-19-37(42)47-25-23-45-29-31-16-10-7-11-17-31/h6-11,14-17,26-27,40H,12-13,18-25,28-29H2,1-5H3