octadecyl 5,5-dimethyl-7-oxabicyclo[4.1.0]heptane-4-carboxylate

Systemtic Name: octadecyl 5,5-dimethyl-7-oxabicyclo[4.1.0]heptane-4-carboxylate Openeye Name: octadecyl 5,5-dimethyl-7-oxabicyclo[4.1.0]heptane-4-carboxylate CAS Name: 5,5-dimethyl-7-oxabicyclo[4.1.0]heptane-4-carboxylic acid octadecyl ester IUPAC Name: octadecyl 5,5-dimethyl-7-oxabicyclo[4.1.0]heptane-4-carboxylate Traditional Name: 5,5-dimethyl-7-oxabicyclo[4.1.0]heptane-4-carboxylic acid stearyl ester Formula: C27H50O3 MolecularWeight: 422.6841

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC(=O)C1CCC2C(C1(C)C)O2

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC(=O)C1CCC2C(C1(C)C)O2

InChI

InChI=1S/C27H50O3/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22-29-26(28)23-20-21-24-25(30-24)27(23,2)3/h23-25H,4-22H2,1-3H3