1-benzofuran-7-yl 2,2,6-trimethyl-3,5-bis(oxidanyl)-4-propan-2-yl-heptanoate

Systemtic Name: 1-benzofuran-7-yl 2,2,6-trimethyl-3,5-bis(oxidanyl)-4-propan-2-yl-heptanoate Openeye Name: benzofuran-7-yl 3,5-dihydroxy-4-isopropyl-2,2,6-trimethyl-heptanoate CAS Name: 3,5-dihydroxy-2,2,6-trimethyl-4-propan-2-ylheptanoic acid 7-benzofuranyl ester IUPAC Name: 1-benzofuran-7-yl 3,5-dihydroxy-2,2,6-trimethyl-4-propan-2-ylheptanoate Traditional Name: 3,5-dihydroxy-4-isopropyl-2,2,6-trimethyl-enanthic acid benzofuran-7-yl ester Formula: C21H30O5 MolecularWeight: 362.4599

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H30O5/c1-12(2)16(17(22)13(3)4)19(23)21(5,6)20(24)26-15-9-7-8-14-10-11-25-18(14)15/h7-13,16-17,19,22-23H,1-6H3