4-butan-2-yl-4-ethoxycarbonyl-7-oxabicyclo[4.1.0]heptane-3-carboxylic acid

Systemtic Name: 4-butan-2-yl-4-ethoxycarbonyl-7-oxabicyclo[4.1.0]heptane-3-carboxylic acid Openeye Name: 4-ethoxycarbonyl-4-sec-butyl-7-oxabicyclo[4.1.0]heptane-3-carboxylic acid CAS Name: 4-butan-2-yl-4-ethoxycarbonyl-7-oxabicyclo[4.1.0]heptane-3-carboxylic acid IUPAC Name: 4-butan-2-yl-4-ethoxycarbonyl-7-oxabicyclo[4.1.0]heptane-3-carboxylic acid Traditional Name: 4-carbethoxy-4-sec-butyl-7-oxabicyclo[4.1.0]heptane-3-carboxylic acid Formula: C14H22O5 MolecularWeight: 270.32148

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1(CC2C(O2)CC1C(=O)O)C(=O)OCC

Isomeric SMILES

CCC(C)C1(CC2C(O2)CC1C(=O)O)C(=O)OCC

InChI

InChI=1S/C14H22O5/c1-4-8(3)14(13(17)18-5-2)7-11-10(19-11)6-9(14)12(15)16/h8-11H,4-7H2,1-3H3,(H,15,16)