1-benzofuran-7-yl 4-tert-butyl-2,2,6-trimethyl-5-oxidanyl-3-oxidanylidene-5-phenylmethoxy-heptanoate

Systemtic Name: 1-benzofuran-7-yl 4-tert-butyl-2,2,6-trimethyl-5-oxidanyl-3-oxidanylidene-5-phenylmethoxy-heptanoate Openeye Name: benzofuran-7-yl 5-benzyloxy-4-tert-butyl-5-hydroxy-2,2,6-trimethyl-3-oxo-heptanoate CAS Name: 4-tert-butyl-5-hydroxy-2,2,6-trimethyl-3-oxo-5-phenylmethoxyheptanoic acid 7-benzofuranyl ester IUPAC Name: 1-benzofuran-7-yl 4-tert-butyl-5-hydroxy-2,2,6-trimethyl-3-oxo-5-phenylmethoxyheptanoate Traditional Name: 5-benzoxy-4-tert-butyl-5-hydroxy-3-keto-2,2,6-trimethyl-enanthic acid benzofuran-7-yl ester Formula: C29H36O6 MolecularWeight: 480.59254

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(C(=O)C(C)(C)C(=O)OC1=CC=CC2=C1OC=C2)C(C)(C)C)(O)OCC3=CC=CC=C3

Isomeric SMILES

CC(C)C(C(C(=O)C(C)(C)C(=O)OC1=CC=CC2=C1OC=C2)C(C)(C)C)(O)OCC3=CC=CC=C3

InChI

InChI=1S/C29H36O6/c1-19(2)29(32,34-18-20-12-9-8-10-13-20)24(27(3,4)5)25(30)28(6,7)26(31)35-22-15-11-14-21-16-17-33-23(21)22/h8-17,19,24,32H,18H2,1-7H3