[(3R)-8-[(4R,5R)-5-heptyl-2,2-dimethyl-1,3-dioxolan-4-yl]octan-3-yl] ethanoate

Systemtic Name: [(3R)-8-[(4R,5R)-5-heptyl-2,2-dimethyl-1,3-dioxolan-4-yl]octan-3-yl] ethanoate Openeye Name: [(1R)-1-ethyl-6-[(4R,5R)-5-heptyl-2,2-dimethyl-1,3-dioxolan-4-yl]hexyl] acetate CAS Name: acetic acid [(3R)-8-[(4R,5R)-5-heptyl-2,2-dimethyl-1,3-dioxolan-4-yl]octan-3-yl] ester IUPAC Name: [(3R)-8-[(4R,5R)-5-heptyl-2,2-dimethyl-1,3-dioxolan-4-yl]octan-3-yl] acetate Traditional Name: acetic acid [(1R)-1-ethyl-6-[(4R,5R)-5-heptyl-2,2-dimethyl-1,3-dioxolan-4-yl]hexyl] ester Formula: C22H42O4 MolecularWeight: 370.56648

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1C(OC(O1)(C)C)CCCCCC(CC)OC(=O)C

Isomeric SMILES

CCCCCCC[C@@H]1[C@H](OC(O1)(C)C)CCCCC[C@@H](CC)OC(=O)C

InChI

InChI=1S/C22H42O4/c1-6-8-9-10-13-16-20-21(26-22(4,5)25-20)17-14-11-12-15-19(7-2)24-18(3)23/h19-21H,6-17H2,1-5H3/t19-,20-,21-/m1/s1