ethyl (2S,3R)-6,7-dimethyl-4-(4-methylphenyl)carbonyl-2,5-bis(oxidanyl)-2-propyl-3H-1-benzofuran-3-carboxylate

Systemtic Name: ethyl (2S,3R)-6,7-dimethyl-4-(4-methylphenyl)carbonyl-2,5-bis(oxidanyl)-2-propyl-3H-1-benzofuran-3-carboxylate Openeye Name: ethyl (2S,3R)-2,5-dihydroxy-6,7-dimethyl-4-(4-methylbenzoyl)-2-propyl-3H-benzofuran-3-carboxylate CAS Name: (2S,3R)-2,5-dihydroxy-6,7-dimethyl-4-[(4-methylphenyl)-oxomethyl]-2-propyl-3H-benzofuran-3-carboxylic acid ethyl ester IUPAC Name: ethyl (2S,3R)-2,5-dihydroxy-6,7-dimethyl-4-(4-methylbenzoyl)-2-propyl-3H-1-benzofuran-3-carboxylate Traditional Name: (2S,3R)-2,5-dihydroxy-6,7-dimethyl-2-propyl-4-p-toluoyl-coumaran-3-carboxylic acid ethyl ester Formula: C24H28O6 MolecularWeight: 412.47552

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1(C(C2=C(C(=C(C(=C2O1)C)C)O)C(=O)C3=CC=C(C=C3)C)C(=O)OCC)O

Isomeric SMILES

CCC[C@]1([C@@H](C2=C(C(=C(C(=C2O1)C)C)O)C(=O)C3=CC=C(C=C3)C)C(=O)OCC)O

InChI

InChI=1S/C24H28O6/c1-6-12-24(28)19(23(27)29-7-2)17-18(20(25)14(4)15(5)22(17)30-24)21(26)16-10-8-13(3)9-11-16/h8-11,19,25,28H,6-7,12H2,1-5H3/t19-,24-/m0/s1