1-deuteriooctyl (1R,4S)-1,7,7-trimethyl-2-oxidanylidene-3-oxabicyclo[2.2.1]heptane-4-carboxylate

Systemtic Name: 1-deuteriooctyl (1R,4S)-1,7,7-trimethyl-2-oxidanylidene-3-oxabicyclo[2.2.1]heptane-4-carboxylate Openeye Name: 1-deuteriooctyl (1R,4S)-1,7,7-trimethyl-2-oxo-3-oxabicyclo[2.2.1]heptane-4-carboxylate CAS Name: (1R,4S)-1,7,7-trimethyl-2-oxo-3-oxabicyclo[2.2.1]heptane-4-carboxylic acid 1-deuteriooctyl ester IUPAC Name: 1-deuteriooctyl (1R,4S)-1,7,7-trimethyl-2-oxo-3-oxabicyclo[2.2.1]heptane-4-carboxylate Traditional Name: (1R,4S)-2-keto-1,7,7-trimethyl-3-oxabicyclo[2.2.1]heptane-4-carboxylic acid 1-deuteriooctyl ester Formula: C18H30O4 MolecularWeight: 311.434562

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC(=O)C12CCC(C1(C)C)(C(=O)O2)C

Isomeric SMILES

[2H]C(CCCCCCC)OC(=O)[C@]12CC[C@](C1(C)C)(C(=O)O2)C

InChI

InChI=1S/C18H30O4/c1-5-6-7-8-9-10-13-21-15(20)18-12-11-17(4,14(19)22-18)16(18,2)3/h5-13H2,1-4H3/t17-,18+/m0/s1/i13D/t13?,17-,18+