ethyl (3aR,7aR)-7a-oxidanyl-1-oxidanylidene-2,3,4,5,6,7-hexahydroindene-3a-carboxylate

Systemtic Name: ethyl (3aR,7aR)-7a-oxidanyl-1-oxidanylidene-2,3,4,5,6,7-hexahydroindene-3a-carboxylate Openeye Name: ethyl (3aR,7aR)-7a-hydroxy-1-oxo-2,3,4,5,6,7-hexahydroindene-3a-carboxylate CAS Name: (3aR,7aR)-7a-hydroxy-1-oxo-2,3,4,5,6,7-hexahydroindene-3a-carboxylic acid ethyl ester IUPAC Name: ethyl (3aR,7aR)-7a-hydroxy-1-oxo-2,3,4,5,6,7-hexahydroindene-3a-carboxylate Traditional Name: (3aR,7aR)-7a-hydroxy-1-keto-2,3,4,5,6,7-hexahydroindene-3a-carboxylic acid ethyl ester Formula: C12H18O4 MolecularWeight: 226.26892

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C12CCCCC1(C(=O)CC2)O

Isomeric SMILES

CCOC(=O)[C@@]12CCCC[C@@]1(C(=O)CC2)O

InChI

InChI=1S/C12H18O4/c1-2-16-10(14)11-6-3-4-7-12(11,15)9(13)5-8-11/h15H,2-8H2,1H3/t11-,12-/m0/s1