dibutyl (1R,6S)-5-tert-butyl-7-oxabicyclo[4.1.0]heptane-3,3-dicarboxylate

Systemtic Name: dibutyl (1R,6S)-5-tert-butyl-7-oxabicyclo[4.1.0]heptane-3,3-dicarboxylate Openeye Name: dibutyl (1R,6S)-5-tert-butyl-7-oxabicyclo[4.1.0]heptane-3,3-dicarboxylate CAS Name: (1R,6S)-5-tert-butyl-7-oxabicyclo[4.1.0]heptane-3,3-dicarboxylic acid dibutyl ester IUPAC Name: dibutyl (1R,6S)-5-tert-butyl-7-oxabicyclo[4.1.0]heptane-3,3-dicarboxylate Traditional Name: (1R,6S)-5-tert-butyl-7-oxabicyclo[4.1.0]heptane-3,3-dicarboxylic acid dibutyl ester Formula: C20H34O5 MolecularWeight: 354.48096

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1(CC(C2C(C1)O2)C(C)(C)C)C(=O)OCCCC

Isomeric SMILES

CCCCOC(=O)C1(C[C@@H]2[C@@H](O2)C(C1)C(C)(C)C)C(=O)OCCCC

InChI

InChI=1S/C20H34O5/c1-6-8-10-23-17(21)20(18(22)24-11-9-7-2)12-14(19(3,4)5)16-15(13-20)25-16/h14-16H,6-13H2,1-5H3/t14?,15-,16+/m1/s1