dimethyl 2-[(E,2S,3R)-3,7,7-trimethyl-4-oxidanylidene-oct-5-en-2-yl]propanedioate

Systemtic Name: dimethyl 2-[(E,2S,3R)-3,7,7-trimethyl-4-oxidanylidene-oct-5-en-2-yl]propanedioate Openeye Name: dimethyl 2-[(E,1S,2R)-1,2,6,6-tetramethyl-3-oxo-hept-4-enyl]propanedioate CAS Name: 2-[(E,2S,3R)-3,7,7-trimethyl-4-oxooct-5-en-2-yl]propanedioic acid dimethyl ester IUPAC Name: dimethyl 2-[(E,2S,3R)-3,7,7-trimethyl-4-oxooct-5-en-2-yl]propanedioate Traditional Name: 2-[(E,1S,2R)-3-keto-1,2,6,6-tetramethyl-hept-4-enyl]malonic acid dimethyl ester Formula: C16H26O5 MolecularWeight: 298.37464

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C)C(=O)C=CC(C)(C)C)C(C(=O)OC)C(=O)OC

Isomeric SMILES

C[C@@H]([C@@H](C)C(=O)/C=C/C(C)(C)C)C(C(=O)OC)C(=O)OC

InChI

InChI=1S/C16H26O5/c1-10(12(17)8-9-16(3,4)5)11(2)13(14(18)20-6)15(19)21-7/h8-11,13H,1-7H3/b9-8+/t10-,11+/m1/s1