methyl (5S,5aS,8R)-8-oxidanyl-5a,6,7,8-tetrahydro-5H-cyclopenta[c]oxepine-5-carboxylate

Systemtic Name: methyl (5S,5aS,8R)-8-oxidanyl-5a,6,7,8-tetrahydro-5H-cyclopenta[c]oxepine-5-carboxylate Openeye Name: methyl (5S,5aS,8R)-8-hydroxy-5a,6,7,8-tetrahydro-5H-cyclopenta[c]oxepine-5-carboxylate CAS Name: (5S,5aS,8R)-8-hydroxy-5a,6,7,8-tetrahydro-5H-cyclopenta[c]oxepin-5-carboxylic acid methyl ester IUPAC Name: methyl (5S,5aS,8R)-8-hydroxy-5a,6,7,8-tetrahydro-5H-cyclopenta[c]oxepine-5-carboxylate Traditional Name: (5S,5aS,8R)-8-hydroxy-5a,6,7,8-tetrahydro-5H-cyclopenta[c]oxepin-5-carboxylic acid methyl ester Formula: C11H14O4 MolecularWeight: 210.22646

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1C=COC=C2C1CCC2O

Isomeric SMILES

COC(=O)[C@@H]1C=COC=C2[C@H]1CC[C@H]2O

InChI

InChI=1S/C11H14O4/c1-14-11(13)8-4-5-15-6-9-7(8)2-3-10(9)12/h4-8,10,12H,2-3H2,1H3/t7-,8+,10+/m0/s1