(3R)-5,7-dimethoxy-3-[(13R)-13-oxidanyl-10-oxidanylidene-tetradecyl]-3H-2-benzofuran-1-one

Systemtic Name: (3R)-5,7-dimethoxy-3-[(13R)-13-oxidanyl-10-oxidanylidene-tetradecyl]-3H-2-benzofuran-1-one Openeye Name: (3R)-3-[(13R)-13-hydroxy-10-oxo-tetradecyl]-5,7-dimethoxy-3H-isobenzofuran-1-one CAS Name: (3R)-3-[(13R)-13-hydroxy-10-oxotetradecyl]-5,7-dimethoxy-3H-isobenzofuran-1-one IUPAC Name: (3R)-3-[(13R)-13-hydroxy-10-oxotetradecyl]-5,7-dimethoxy-3H-2-benzofuran-1-one Traditional Name: (3R)-3-[(13R)-13-hydroxy-10-keto-tetradecyl]-5,7-dimethoxy-phthalide Formula: C24H36O6 MolecularWeight: 420.53904

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC(=O)CCCCCCCCCC1C2=CC(=CC(=C2C(=O)O1)OC)OC)O

Isomeric SMILES

C[C@H](CCC(=O)CCCCCCCCC[C@@H]1C2=CC(=CC(=C2C(=O)O1)OC)OC)O

InChI

InChI=1S/C24H36O6/c1-17(25)13-14-18(26)11-9-7-5-4-6-8-10-12-21-20-15-19(28-2)16-22(29-3)23(20)24(27)30-21/h15-17,21,25H,4-14H2,1-3H3/t17-,21-/m1/s1