(2E)-3,3-diethyl-6-methyl-6-oxidanyl-2-propylidene-octanoate

Systemtic Name: (2E)-3,3-diethyl-6-methyl-6-oxidanyl-2-propylidene-octanoate Openeye Name: (2E)-3,3-diethyl-6-hydroxy-6-methyl-2-propylidene-octanoate CAS Name: (2E)-3,3-diethyl-6-hydroxy-6-methyl-2-propylideneoctanoate IUPAC Name: (2E)-3,3-diethyl-6-hydroxy-6-methyl-2-propylideneoctanoate Traditional Name: (E)-2-(1,1-diethyl-4-hydroxy-4-methyl-hexyl)pent-2-enoate Formula: C16H29O3- MolecularWeight: 269.39966

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC/C=C(/C(=O)[O-])\C(CC)(CC)CCC(C)(CC)O

InChI

InChI=1S/C16H30O3/c1-6-10-13(14(17)18)16(8-3,9-4)12-11-15(5,19)7-2/h10,19H,6-9,11-12H2,1-5H3,(H,17,18)/p-1/b13-10-