methyl (3aR,4S,7aR)-4-acetyloxy-2,2-dimethyl-7-oxidanylidene-4,7a-dihydro-3aH-1,3-benzodioxole-5-carboxylate

Systemtic Name: methyl (3aR,4S,7aR)-4-acetyloxy-2,2-dimethyl-7-oxidanylidene-4,7a-dihydro-3aH-1,3-benzodioxole-5-carboxylate Openeye Name: methyl (3aR,4S,7aR)-4-acetoxy-2,2-dimethyl-7-oxo-4,7a-dihydro-3aH-1,3-benzodioxole-5-carboxylate CAS Name: (3aR,4S,7aR)-4-acetyloxy-2,2-dimethyl-7-oxo-4,7a-dihydro-3aH-1,3-benzodioxole-5-carboxylic acid methyl ester IUPAC Name: methyl (3aR,4S,7aR)-4-acetyloxy-2,2-dimethyl-7-oxo-4,7a-dihydro-3aH-1,3-benzodioxole-5-carboxylate Traditional Name: (3aR,4S,7aR)-4-acetoxy-7-keto-2,2-dimethyl-4,7a-dihydro-3aH-1,3-benzodioxole-5-carboxylic acid methyl ester Formula: C13H16O7 MolecularWeight: 284.26194

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1C2C(C(=O)C=C1C(=O)OC)OC(O2)(C)C

Isomeric SMILES

CC(=O)O[C@@H]1[C@@H]2[C@H](C(=O)C=C1C(=O)OC)OC(O2)(C)C

InChI

InChI=1S/C13H16O7/c1-6(14)18-9-7(12(16)17-4)5-8(15)10-11(9)20-13(2,3)19-10/h5,9-11H,1-4H3/t9-,10-,11+/m0/s1