methyl (3aR,7R,7aS)-6-deuterio-2,2-dimethyl-7-oxidanyl-3a,6,7,7a-tetrahydro-1,3-benzodioxole-5-carboxylate

Systemtic Name: methyl (3aR,7R,7aS)-6-deuterio-2,2-dimethyl-7-oxidanyl-3a,6,7,7a-tetrahydro-1,3-benzodioxole-5-carboxylate Openeye Name: methyl (3aR,7R,7aS)-6-deuterio-7-hydroxy-2,2-dimethyl-3a,6,7,7a-tetrahydro-1,3-benzodioxole-5-carboxylate CAS Name: (3aR,7R,7aS)-6-deuterio-7-hydroxy-2,2-dimethyl-3a,6,7,7a-tetrahydro-1,3-benzodioxole-5-carboxylic acid methyl ester IUPAC Name: methyl (3aR,7R,7aS)-6-deuterio-7-hydroxy-2,2-dimethyl-3a,6,7,7a-tetrahydro-1,3-benzodioxole-5-carboxylate Traditional Name: (3aR,7R,7aS)-6-deuterio-7-hydroxy-2,2-dimethyl-3a,6,7,7a-tetrahydro-1,3-benzodioxole-5-carboxylic acid methyl ester Formula: C11H16O5 MolecularWeight: 229.247902

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OC2C=C(CC(C2O1)O)C(=O)OC)C

Isomeric SMILES

[2H]C1[C@H]([C@H]2[C@@H](C=C1C(=O)OC)OC(O2)(C)C)O

InChI

InChI=1S/C11H16O5/c1-11(2)15-8-5-6(10(13)14-3)4-7(12)9(8)16-11/h5,7-9,12H,4H2,1-3H3/t7-,8-,9+/m1/s1/i4D/t4?,7-,8-,9+