[(2S)-2-methylbutyl] 4-[4-[4-(4-nonanoyloxyphenyl)phenyl]carbonyloxyphenyl]benzoate

Systemtic Name: [(2S)-2-methylbutyl] 4-[4-[4-(4-nonanoyloxyphenyl)phenyl]carbonyloxyphenyl]benzoate Openeye Name: [(2S)-2-methylbutyl] 4-[4-[4-(4-nonanoyloxyphenyl)benzoyl]oxyphenyl]benzoate CAS Name: 4-[4-[oxo-[4-[4-(1-oxononoxy)phenyl]phenyl]methoxy]phenyl]benzoic acid [(2S)-2-methylbutyl] ester IUPAC Name: [(2S)-2-methylbutyl] 4-[4-[4-(4-nonanoyloxyphenyl)benzoyl]oxyphenyl]benzoate Traditional Name: 4-[4-[4-(4-pelargonyloxyphenyl)benzoyl]oxyphenyl]benzoic acid [(2S)-2-methylbutyl] ester Formula: C40H44O6 MolecularWeight: 620.77376

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(=O)OC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC3=CC=C(C=C3)C4=CC=C(C=C4)C(=O)OCC(C)CC

Isomeric SMILES

CCCCCCCCC(=O)OC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC3=CC=C(C=C3)C4=CC=C(C=C4)C(=O)OC[C@@H](C)CC

InChI

InChI=1S/C40H44O6/c1-4-6-7-8-9-10-11-38(41)45-36-24-20-32(21-25-36)31-14-18-35(19-15-31)40(43)46-37-26-22-33(23-27-37)30-12-16-34(17-13-30)39(42)44-28-29(3)5-2/h12-27,29H,4-11,28H2,1-3H3/t29-/m0/s1