3-oxidanylidenebutanoyl (Z)-2-methylhept-2-eneperoxoate

Systemtic Name: 3-oxidanylidenebutanoyl (Z)-2-methylhept-2-eneperoxoate Openeye Name: 3-oxobutanoyl (Z)-2-methylhept-2-eneperoxoate CAS Name: (Z)-2-methyl-2-hepteneperoxoic acid 1,3-dioxobutyl ester IUPAC Name: 3-oxobutanoyl (Z)-2-methylhept-2-eneperoxoate Traditional Name: (Z)-2-methylhept-2-eneperoxoic acid acetoacetyl ester Formula: C12H18O5 MolecularWeight: 242.26832

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC=C(C)C(=O)OOC(=O)CC(=O)C

Isomeric SMILES

CCCC/C=C(/C)\C(=O)OOC(=O)CC(=O)C

InChI

InChI=1S/C12H18O5/c1-4-5-6-7-9(2)12(15)17-16-11(14)8-10(3)13/h7H,4-6,8H2,1-3H3/b9-7-