[4-(2-methoxy-2-oxidanylidene-ethyl)-5-methyl-3-(phenylcarbonyloxy)-6-(2-tetradecylhexadecoxy)oxan-2-yl]methyl benzoate

Systemtic Name: [4-(2-methoxy-2-oxidanylidene-ethyl)-5-methyl-3-(phenylcarbonyloxy)-6-(2-tetradecylhexadecoxy)oxan-2-yl]methyl benzoate Openeye Name: [3-benzoyloxy-4-(2-methoxy-2-oxo-ethyl)-5-methyl-6-(2-tetradecylhexadecoxy)tetrahydropyran-2-yl]methyl benzoate CAS Name: benzoic acid [3-benzoyloxy-4-(2-methoxy-2-oxoethyl)-5-methyl-6-(2-tetradecylhexadecoxy)-2-oxanyl]methyl ester IUPAC Name: [3-benzoyloxy-4-(2-methoxy-2-oxoethyl)-5-methyl-6-(2-tetradecylhexadecoxy)oxan-2-yl]methyl benzoate Traditional Name: benzoic acid [3-benzoyloxy-4-(2-keto-2-methoxy-ethyl)-5-methyl-6-(2-myristylhexadecoxy)tetrahydropyran-2-yl]methyl ester Formula: C54H86O8 MolecularWeight: 863.25584

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCC(CCCCCCCCCCCCCC)COC1C(C(C(C(O1)COC(=O)C2=CC=CC=C2)OC(=O)C3=CC=CC=C3)CC(=O)OC)C

Isomeric SMILES

CCCCCCCCCCCCCCC(CCCCCCCCCCCCCC)COC1C(C(C(C(O1)COC(=O)C2=CC=CC=C2)OC(=O)C3=CC=CC=C3)CC(=O)OC)C

InChI

InChI=1S/C54H86O8/c1-5-7-9-11-13-15-17-19-21-23-25-29-35-45(36-30-26-24-22-20-18-16-14-12-10-8-6-2)42-60-54-44(3)48(41-50(55)58-4)51(62-53(57)47-39-33-28-34-40-47)49(61-54)43-59-52(56)46-37-31-27-32-38-46/h27-28,31-34,37-40,44-45,48-49,51,54H,5-26,29-30,35-36,41-43H2,1-4H3