methyl (1S,5S)-3-oxidanylidene-8-oxabicyclo[3.2.1]oct-6-ene-4-carboxylate

Systemtic Name: methyl (1S,5S)-3-oxidanylidene-8-oxabicyclo[3.2.1]oct-6-ene-4-carboxylate Openeye Name: methyl (1S,5S)-3-oxo-8-oxabicyclo[3.2.1]oct-6-ene-4-carboxylate CAS Name: (1S,5S)-3-oxo-8-oxabicyclo[3.2.1]oct-6-ene-4-carboxylic acid methyl ester IUPAC Name: methyl (1S,5S)-3-oxo-8-oxabicyclo[3.2.1]oct-6-ene-4-carboxylate Traditional Name: (1S,5S)-3-keto-8-oxabicyclo[3.2.1]oct-6-ene-4-carboxylic acid methyl ester Formula: C9H10O4 MolecularWeight: 182.1733

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1C2C=CC(O2)CC1=O

Isomeric SMILES

COC(=O)C1[C@@H]2C=C[C@@H](O2)CC1=O

InChI

InChI=1S/C9H10O4/c1-12-9(11)8-6(10)4-5-2-3-7(8)13-5/h2-3,5,7-8H,4H2,1H3/t5-,7+,8?/m1/s1