methyl 2-[(3R)-3-methyl-5-[(1R,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl]oxycarbonyloxy-2-oxidanylidene-1-benzofuran-3-yl]ethanoate

Systemtic Name: methyl 2-[(3R)-3-methyl-5-[(1R,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl]oxycarbonyloxy-2-oxidanylidene-1-benzofuran-3-yl]ethanoate Openeye Name: methyl 2-[(3R)-5-[(1R,2S,5R)-2-isopropyl-5-methyl-cyclohexoxy]carbonyloxy-3-methyl-2-oxo-benzofuran-3-yl]acetate CAS Name: 2-[(3R)-3-methyl-5-[[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl]oxy-oxomethoxy]-2-oxo-3-benzofuranyl]acetic acid methyl ester IUPAC Name: methyl 2-[(3R)-3-methyl-5-[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl]oxycarbonyloxy-2-oxo-1-benzofuran-3-yl]acetate Traditional Name: 2-[(3R)-5-[(1R,2S,5R)-2-isopropyl-5-methyl-cyclohexoxy]carbonyloxy-2-keto-3-methyl-coumaran-3-yl]acetic acid methyl ester Formula: C23H30O7 MolecularWeight: 418.4801

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)OC(=O)OC2=CC3=C(C=C2)OC(=O)C3(C)CC(=O)OC)C(C)C

Isomeric SMILES

C[C@@H]1CC[C@H]([C@@H](C1)OC(=O)OC2=CC3=C(C=C2)OC(=O)[C@]3(C)CC(=O)OC)C(C)C

InChI

InChI=1S/C23H30O7/c1-13(2)16-8-6-14(3)10-19(16)30-22(26)28-15-7-9-18-17(11-15)23(4,21(25)29-18)12-20(24)27-5/h7,9,11,13-14,16,19H,6,8,10,12H2,1-5H3/t14-,16+,19-,23-/m1/s1