[(Z)-3-[(4R,5S,6S)-2,2,5-trimethyl-6-(2-oxidanylideneethyl)-1,3-dioxan-4-yl]but-2-enyl] 2,2-dimethylpropanoate

Systemtic Name: [(Z)-3-[(4R,5S,6S)-2,2,5-trimethyl-6-(2-oxidanylideneethyl)-1,3-dioxan-4-yl]but-2-enyl] 2,2-dimethylpropanoate Openeye Name: [(Z)-3-[(4R,5S,6S)-2,2,5-trimethyl-6-(2-oxoethyl)-1,3-dioxan-4-yl]but-2-enyl] 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid [(Z)-3-[(4R,5S,6S)-2,2,5-trimethyl-6-(2-oxoethyl)-1,3-dioxan-4-yl]but-2-enyl] ester IUPAC Name: [(Z)-3-[(4R,5S,6S)-2,2,5-trimethyl-6-(2-oxoethyl)-1,3-dioxan-4-yl]but-2-enyl] 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid [(Z)-3-[(4R,5S,6S)-6-(2-ketoethyl)-2,2,5-trimethyl-1,3-dioxan-4-yl]but-2-enyl] ester Formula: C18H30O5 MolecularWeight: 326.4278

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(OC(OC1C(=CCOC(=O)C(C)(C)C)C)(C)C)CC=O

Isomeric SMILES

C[C@H]1[C@@H](OC(O[C@H]1/C(=C\COC(=O)C(C)(C)C)/C)(C)C)CC=O

InChI

InChI=1S/C18H30O5/c1-12(9-11-21-16(20)17(3,4)5)15-13(2)14(8-10-19)22-18(6,7)23-15/h9-10,13-15H,8,11H2,1-7H3/b12-9-/t13-,14-,15-/m0/s1