2-methylbutyl 4-[[4-[12-(2,2-diacetyloxypropanoyloxy)dodecoxy]phenyl]methoxy]benzoate

Systemtic Name: 2-methylbutyl 4-[[4-[12-(2,2-diacetyloxypropanoyloxy)dodecoxy]phenyl]methoxy]benzoate Openeye Name: 2-methylbutyl 4-[[4-[12-(2,2-diacetoxypropanoyloxy)dodecoxy]phenyl]methoxy]benzoate CAS Name: 4-[[4-[12-(2,2-diacetyloxy-1-oxopropoxy)dodecoxy]phenyl]methoxy]benzoic acid 2-methylbutyl ester IUPAC Name: 2-methylbutyl 4-[[4-[12-(2,2-diacetyloxypropanoyloxy)dodecoxy]phenyl]methoxy]benzoate Traditional Name: 4-[4-[12-(2,2-diacetoxypropanoyloxy)dodecoxy]benzyl]oxybenzoic acid 2-methylbutyl ester Formula: C38H54O10 MolecularWeight: 670.82936

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)COC(=O)C1=CC=C(C=C1)OCC2=CC=C(C=C2)OCCCCCCCCCCCCOC(=O)C(C)(OC(=O)C)OC(=O)C

Isomeric SMILES

CCC(C)COC(=O)C1=CC=C(C=C1)OCC2=CC=C(C=C2)OCCCCCCCCCCCCOC(=O)C(C)(OC(=O)C)OC(=O)C

InChI

InChI=1S/C38H54O10/c1-6-29(2)27-46-36(41)33-19-23-35(24-20-33)45-28-32-17-21-34(22-18-32)43-25-15-13-11-9-7-8-10-12-14-16-26-44-37(42)38(5,47-30(3)39)48-31(4)40/h17-24,29H,6-16,25-28H2,1-5H3