(E,3S,7R)-6-ethyl-3,7-dimethyl-8-[(2-methylpropan-2-yl)oxy]oct-4-enoate

Systemtic Name: (E,3S,7R)-6-ethyl-3,7-dimethyl-8-[(2-methylpropan-2-yl)oxy]oct-4-enoate Openeye Name: (E,3S,7R)-8-tert-butoxy-6-ethyl-3,7-dimethyl-oct-4-enoate CAS Name: (E,3S,7R)-6-ethyl-3,7-dimethyl-8-[(2-methylpropan-2-yl)oxy]-4-octenoate IUPAC Name: (E,3S,7R)-6-ethyl-3,7-dimethyl-8-[(2-methylpropan-2-yl)oxy]oct-4-enoate Traditional Name: (E,3S,7R)-8-tert-butoxy-6-ethyl-3,7-dimethyl-oct-4-enoate Formula: C16H29O3- MolecularWeight: 269.39966

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C=CC(C)CC(=O)[O-])C(C)COC(C)(C)C

Isomeric SMILES

CCC(/C=C/[C@@H](C)CC(=O)[O-])[C@@H](C)COC(C)(C)C

InChI

InChI=1S/C16H30O3/c1-7-14(9-8-12(2)10-15(17)18)13(3)11-19-16(4,5)6/h8-9,12-14H,7,10-11H2,1-6H3,(H,17,18)/p-1/b9-8+/t12-,13+,14?/m1/s1