ethyl 5-(3-butyloxiran-2-yl)-2-(8-ethoxy-8-oxidanylidene-octyl)-7-oxabicyclo[4.1.0]heptane-4-carboxylate

Systemtic Name: ethyl 5-(3-butyloxiran-2-yl)-2-(8-ethoxy-8-oxidanylidene-octyl)-7-oxabicyclo[4.1.0]heptane-4-carboxylate Openeye Name: ethyl 5-(3-butyloxiran-2-yl)-2-(8-ethoxy-8-oxo-octyl)-7-oxabicyclo[4.1.0]heptane-4-carboxylate CAS Name: 5-(3-butyl-2-oxiranyl)-2-(8-ethoxy-8-oxooctyl)-7-oxabicyclo[4.1.0]heptane-4-carboxylic acid ethyl ester IUPAC Name: ethyl 5-(3-butyloxiran-2-yl)-2-(8-ethoxy-8-oxooctyl)-7-oxabicyclo[4.1.0]heptane-4-carboxylate Traditional Name: 5-(3-butyloxiran-2-yl)-2-(8-ethoxy-8-keto-octyl)-7-oxabicyclo[4.1.0]heptane-4-carboxylic acid ethyl ester Formula: C25H42O6 MolecularWeight: 438.59738

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1C(O1)C2C(CC(C3C2O3)CCCCCCCC(=O)OCC)C(=O)OCC

Isomeric SMILES

CCCCC1C(O1)C2C(CC(C3C2O3)CCCCCCCC(=O)OCC)C(=O)OCC

InChI

InChI=1S/C25H42O6/c1-4-7-14-19-23(30-19)21-18(25(27)29-6-3)16-17(22-24(21)31-22)13-11-9-8-10-12-15-20(26)28-5-2/h17-19,21-24H,4-16H2,1-3H3