1-benzofuran-7-yl 2,2,4,6,7-pentamethyl-5-oxidanyl-3-oxidanylidene-octanoate

Systemtic Name: 1-benzofuran-7-yl 2,2,4,6,7-pentamethyl-5-oxidanyl-3-oxidanylidene-octanoate Openeye Name: benzofuran-7-yl 5-hydroxy-2,2,4,6,7-pentamethyl-3-oxo-octanoate CAS Name: 5-hydroxy-2,2,4,6,7-pentamethyl-3-oxooctanoic acid 7-benzofuranyl ester IUPAC Name: 1-benzofuran-7-yl 5-hydroxy-2,2,4,6,7-pentamethyl-3-oxooctanoate Traditional Name: 5-hydroxy-3-keto-2,2,4,6,7-pentamethyl-caprylic acid benzofuran-7-yl ester Formula: C21H28O5 MolecularWeight: 360.44402

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H28O5/c1-12(2)13(3)17(22)14(4)19(23)21(5,6)20(24)26-16-9-7-8-15-10-11-25-18(15)16/h7-14,17,22H,1-6H3