2-[4,6,7-trimethyl-2-[2-(2-methyl-4-oxidanylidene-3-phenylmethoxy-pyridin-1-yl)ethyl]-5-oxidanyl-3H-1-benzofuran-2-yl]ethanoate

Systemtic Name: 2-[4,6,7-trimethyl-2-[2-(2-methyl-4-oxidanylidene-3-phenylmethoxy-pyridin-1-yl)ethyl]-5-oxidanyl-3H-1-benzofuran-2-yl]ethanoate Openeye Name: 2-[2-[2-(3-benzyloxy-2-methyl-4-oxo-1-pyridyl)ethyl]-5-hydroxy-4,6,7-trimethyl-3H-benzofuran-2-yl]acetate CAS Name: 2-[5-hydroxy-4,6,7-trimethyl-2-[2-(2-methyl-4-oxo-3-phenylmethoxy-1-pyridinyl)ethyl]-3H-benzofuran-2-yl]acetate IUPAC Name: 2-[5-hydroxy-4,6,7-trimethyl-2-[2-(2-methyl-4-oxo-3-phenylmethoxypyridin-1-yl)ethyl]-3H-1-benzofuran-2-yl]acetate Traditional Name: 2-[2-[2-(3-benzoxy-4-keto-2-methyl-1-pyridyl)ethyl]-5-hydroxy-4,6,7-trimethyl-coumaran-2-yl]acetate Formula: C28H30NO6- MolecularWeight: 476.5409

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C2CC(OC2=C1C)(CCN3C=CC(=O)C(=C3C)OCC4=CC=CC=C4)CC(=O)[O-])C)O

Isomeric SMILES

CC1=C(C(=C2CC(OC2=C1C)(CCN3C=CC(=O)C(=C3C)OCC4=CC=CC=C4)CC(=O)[O-])C)O

InChI

InChI=1S/C28H31NO6/c1-17-18(2)26-22(19(3)25(17)33)14-28(35-26,15-24(31)32)11-13-29-12-10-23(30)27(20(29)4)34-16-21-8-6-5-7-9-21/h5-10,12,33H,11,13-16H2,1-4H3,(H,31,32)/p-1