methyl (3S,3aS,7aS)-3-ethanoyl-4-methanoyl-3a,5-dimethyl-2-oxidanylidene-4,6,7,7a-tetrahydro-3H-1-benzofuran-5-carboxylate

Systemtic Name: methyl (3S,3aS,7aS)-3-ethanoyl-4-methanoyl-3a,5-dimethyl-2-oxidanylidene-4,6,7,7a-tetrahydro-3H-1-benzofuran-5-carboxylate Openeye Name: methyl (3S,3aS,7aS)-3-acetyl-4-formyl-3a,5-dimethyl-2-oxo-4,6,7,7a-tetrahydro-3H-benzofuran-5-carboxylate CAS Name: (3S,3aS,7aS)-3-acetyl-4-formyl-3a,5-dimethyl-2-oxo-4,6,7,7a-tetrahydro-3H-benzofuran-5-carboxylic acid methyl ester IUPAC Name: methyl (3S,3aS,7aS)-3-acetyl-4-formyl-3a,5-dimethyl-2-oxo-4,6,7,7a-tetrahydro-3H-1-benzofuran-5-carboxylate Traditional Name: (3S,3aS,7aS)-3-acetyl-4-formyl-2-keto-3a,5-dimethyl-4,6,7,7a-tetrahydro-3H-benzofuran-5-carboxylic acid methyl ester Formula: C15H20O6 MolecularWeight: 296.3157

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1C(=O)OC2C1(C(C(CC2)(C)C(=O)OC)C=O)C

Isomeric SMILES

CC(=O)[C@H]1C(=O)O[C@@H]2[C@]1(C(C(CC2)(C)C(=O)OC)C=O)C

InChI

InChI=1S/C15H20O6/c1-8(17)11-12(18)21-10-5-6-14(2,13(19)20-4)9(7-16)15(10,11)3/h7,9-11H,5-6H2,1-4H3/t9?,10-,11-,14?,15+/m0/s1