(3aR,7aR)-3a-(methoxymethoxymethyl)-6-methyl-3,4,5,7a-tetrahydro-1-benzofuran-2-one

Systemtic Name: (3aR,7aR)-3a-(methoxymethoxymethyl)-6-methyl-3,4,5,7a-tetrahydro-1-benzofuran-2-one Openeye Name: (3aR,7aR)-3a-(methoxymethoxymethyl)-6-methyl-3,4,5,7a-tetrahydrobenzofuran-2-one CAS Name: (3aR,7aR)-3a-(methoxymethoxymethyl)-6-methyl-3,4,5,7a-tetrahydrobenzofuran-2-one IUPAC Name: (3aR,7aR)-3a-(methoxymethoxymethyl)-6-methyl-3,4,5,7a-tetrahydro-1-benzofuran-2-one Traditional Name: (3aR,7aR)-3a-(methoxymethoxymethyl)-6-methyl-3,4,5,7a-tetrahydrobenzofuran-2-one Formula: C12H18O4 MolecularWeight: 226.26892

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2C(CC1)(CC(=O)O2)COCOC

Isomeric SMILES

CC1=C[C@@H]2[C@](CC1)(CC(=O)O2)COCOC

InChI

InChI=1S/C12H18O4/c1-9-3-4-12(7-15-8-14-2)6-11(13)16-10(12)5-9/h5,10H,3-4,6-8H2,1-2H3/t10-,12-/m1/s1