(2S,3S,3aR)-2-(3,4-dimethoxyphenyl)-3,3a-dimethyl-5-oxidanyl-2,3-dihydro-1-benzofuran-6-one

Systemtic Name: (2S,3S,3aR)-2-(3,4-dimethoxyphenyl)-3,3a-dimethyl-5-oxidanyl-2,3-dihydro-1-benzofuran-6-one Openeye Name: (2S,3S,3aR)-2-(3,4-dimethoxyphenyl)-5-hydroxy-3,3a-dimethyl-2,3-dihydrobenzofuran-6-one CAS Name: (2S,3S,3aR)-2-(3,4-dimethoxyphenyl)-5-hydroxy-3,3a-dimethyl-2,3-dihydrobenzofuran-6-one IUPAC Name: (2S,3S,3aR)-2-(3,4-dimethoxyphenyl)-5-hydroxy-3,3a-dimethyl-2,3-dihydro-1-benzofuran-6-one Traditional Name: (2S,3S,3aR)-2-(3,4-dimethoxyphenyl)-5-hydroxy-3,3a-dimethyl-2,3-dihydrobenzofuran-6-one Formula: C18H20O5 MolecularWeight: 316.3484

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(OC2=CC(=O)C(=CC12C)O)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

C[C@@H]1[C@H](OC2=CC(=O)C(=C[C@@]12C)O)C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C18H20O5/c1-10-17(11-5-6-14(21-3)15(7-11)22-4)23-16-8-12(19)13(20)9-18(10,16)2/h5-10,17,20H,1-4H3/t10-,17+,18+/m1/s1