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

Systemtic Name: ethyl 7-(5-acetamido-2,2,4-trimethyl-6-propan-2-yl-3H-1-benzofuran-7-yl)-3,5-bis(oxidanyl)heptanoate Openeye Name: ethyl 7-(5-acetamido-6-isopropyl-2,2,4-trimethyl-3H-benzofuran-7-yl)-3,5-dihydroxy-heptanoate CAS Name: 7-(5-acetamido-2,2,4-trimethyl-6-propan-2-yl-3H-benzofuran-7-yl)-3,5-dihydroxyheptanoic acid ethyl ester IUPAC Name: ethyl 7-(5-acetamido-2,2,4-trimethyl-6-propan-2-yl-3H-1-benzofuran-7-yl)-3,5-dihydroxyheptanoate Traditional Name: 7-(5-acetamido-6-isopropyl-2,2,4-trimethyl-coumaran-7-yl)-3,5-dihydroxy-enanthic acid ethyl ester Formula: C25H39NO6 MolecularWeight: 449.58026

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(CC(CCC1=C2C(=C(C(=C1C(C)C)NC(=O)C)C)CC(O2)(C)C)O)O

Isomeric SMILES

CCOC(=O)CC(CC(CCC1=C2C(=C(C(=C1C(C)C)NC(=O)C)C)CC(O2)(C)C)O)O

InChI

InChI=1S/C25H39NO6/c1-8-31-21(30)12-18(29)11-17(28)9-10-19-22(14(2)3)23(26-16(5)27)15(4)20-13-25(6,7)32-24(19)20/h14,17-18,28-29H,8-13H2,1-7H3,(H,26,27)