[(1R)-4-dodecoxy-1-(hydroxymethyl)-3-oxidanylidene-2-benzofuran-1-yl]methyl 2-tert-butyl-3,3-dimethyl-butanoate

Systemtic Name: [(1R)-4-dodecoxy-1-(hydroxymethyl)-3-oxidanylidene-2-benzofuran-1-yl]methyl 2-tert-butyl-3,3-dimethyl-butanoate Openeye Name: [(1R)-4-dodecoxy-1-(hydroxymethyl)-3-oxo-isobenzofuran-1-yl]methyl 2-tert-butyl-3,3-dimethyl-butanoate CAS Name: 2-tert-butyl-3,3-dimethylbutanoic acid [(1R)-4-dodecoxy-1-(hydroxymethyl)-3-oxo-1-isobenzofuranyl]methyl ester IUPAC Name: [(1R)-4-dodecoxy-1-(hydroxymethyl)-3-oxo-2-benzofuran-1-yl]methyl 2-tert-butyl-3,3-dimethylbutanoate Traditional Name: 2-tert-butyl-3,3-dimethyl-butyric acid [(1R)-3-keto-4-lauryloxy-1-methylol-phthalan-1-yl]methyl ester Formula: C32H52O6 MolecularWeight: 532.75168

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC1=CC=CC2=C1C(=O)OC2(CO)COC(=O)C(C(C)(C)C)C(C)(C)C

Isomeric SMILES

CCCCCCCCCCCCOC1=CC=CC2=C1C(=O)O[C@]2(CO)COC(=O)C(C(C)(C)C)C(C)(C)C

InChI

InChI=1S/C32H52O6/c1-8-9-10-11-12-13-14-15-16-17-21-36-25-20-18-19-24-26(25)28(34)38-32(24,22-33)23-37-29(35)27(30(2,3)4)31(5,6)7/h18-20,27,33H,8-17,21-23H2,1-7H3/t32-/m1/s1