(E)-2-methyl-6-(3-oxidanylidenebutanoyloxy)hex-2-enoic acid

Systemtic Name: (E)-2-methyl-6-(3-oxidanylidenebutanoyloxy)hex-2-enoic acid Openeye Name: (E)-2-methyl-6-(3-oxobutanoyloxy)hex-2-enoic acid CAS Name: (E)-6-(1,3-dioxobutoxy)-2-methyl-2-hexenoic acid IUPAC Name: (E)-2-methyl-6-(3-oxobutanoyloxy)hex-2-enoic acid Traditional Name: (E)-6-acetoacetyloxy-2-methyl-hex-2-enoic acid Formula: C11H16O5 MolecularWeight: 228.24174

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC(=O)OCCCC=C(C)C(=O)O

Isomeric SMILES

CC(=O)CC(=O)OCCC/C=C(\C)/C(=O)O

InChI

InChI=1S/C11H16O5/c1-8(11(14)15)5-3-4-6-16-10(13)7-9(2)12/h5H,3-4,6-7H2,1-2H3,(H,14,15)/b8-5+