methyl (1S,6R,7R)-7-thiophen-2-yl-8-oxabicyclo[4.2.0]oct-4-ene-7-carboxylate

Systemtic Name: methyl (1S,6R,7R)-7-thiophen-2-yl-8-oxabicyclo[4.2.0]oct-4-ene-7-carboxylate Openeye Name: methyl (1S,6R,7R)-7-(2-thienyl)-8-oxabicyclo[4.2.0]oct-4-ene-7-carboxylate CAS Name: (1S,6R,7R)-7-thiophen-2-yl-8-oxabicyclo[4.2.0]oct-4-ene-7-carboxylic acid methyl ester IUPAC Name: methyl (1S,6R,7R)-7-thiophen-2-yl-8-oxabicyclo[4.2.0]oct-4-ene-7-carboxylate Traditional Name: (1S,6R,7R)-7-(2-thienyl)-8-oxabicyclo[4.2.0]oct-4-ene-7-carboxylic acid methyl ester Formula: C13H14O3S MolecularWeight: 250.31346

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1(C2C=CCCC2O1)C3=CC=CS3

Isomeric SMILES

COC(=O)[C@]1([C@@H]2C=CCC[C@@H]2O1)C3=CC=CS3

InChI

InChI=1S/C13H14O3S/c1-15-12(14)13(11-7-4-8-17-11)9-5-2-3-6-10(9)16-13/h2,4-5,7-10H,3,6H2,1H3/t9-,10+,13+/m1/s1