3-[(E)-5-acetyloxy-2,5-dimethyl-hex-3-en-2-yl]oxy-3-oxidanylidene-propanoic acid

Systemtic Name: 3-[(E)-5-acetyloxy-2,5-dimethyl-hex-3-en-2-yl]oxy-3-oxidanylidene-propanoic acid Openeye Name: 3-[(E)-4-acetoxy-1,1,4-trimethyl-pent-2-enoxy]-3-oxo-propanoic acid CAS Name: 3-[(E)-5-acetyloxy-2,5-dimethylhex-3-en-2-yl]oxy-3-oxopropanoic acid IUPAC Name: 3-[(E)-5-acetyloxy-2,5-dimethylhex-3-en-2-yl]oxy-3-oxopropanoic acid Traditional Name: 3-[(E)-4-acetoxy-1,1,4-trimethyl-pent-2-enoxy]-3-keto-propionic acid Formula: C13H20O6 MolecularWeight: 272.2943

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H20O6/c1-9(14)18-12(2,3)6-7-13(4,5)19-11(17)8-10(15)16/h6-7H,8H2,1-5H3,(H,15,16)/b7-6+