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

Systemtic Name: 1-benzofuran-7-yl 2,2-dimethyl-3,5-bis(oxidanyl)-4-propan-2-yl-heptanoate Openeye Name: benzofuran-7-yl 3,5-dihydroxy-4-isopropyl-2,2-dimethyl-heptanoate CAS Name: 3,5-dihydroxy-2,2-dimethyl-4-propan-2-ylheptanoic acid 7-benzofuranyl ester IUPAC Name: 1-benzofuran-7-yl 3,5-dihydroxy-2,2-dimethyl-4-propan-2-ylheptanoate Traditional Name: 3,5-dihydroxy-4-isopropyl-2,2-dimethyl-enanthic acid benzofuran-7-yl ester Formula: C20H28O5 MolecularWeight: 348.43332

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H28O5/c1-6-14(21)16(12(2)3)18(22)20(4,5)19(23)25-15-9-7-8-13-10-11-24-17(13)15/h7-12,14,16,18,21-22H,6H2,1-5H3