ethyl (E)-4-(2-chloranylbutanoylperoxy)-2,3-dimethyl-4-oxidanylidene-but-2-enoate

Systemtic Name: ethyl (E)-4-(2-chloranylbutanoylperoxy)-2,3-dimethyl-4-oxidanylidene-but-2-enoate Openeye Name: ethyl (E)-4-(2-chlorobutanoylperoxy)-2,3-dimethyl-4-oxo-but-2-enoate CAS Name: (E)-4-(2-chloro-1-oxobutyl)dioxy-2,3-dimethyl-4-oxo-2-butenoic acid ethyl ester IUPAC Name: ethyl (E)-4-(2-chlorobutanoylperoxy)-2,3-dimethyl-4-oxobut-2-enoate Traditional Name: (E)-4-(2-chlorobutanoylperoxy)-4-keto-2,3-dimethyl-but-2-enoic acid ethyl ester Formula: C12H17ClO6 MolecularWeight: 292.71278

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)OOC(=O)C(=C(C)C(=O)OCC)C)Cl

Isomeric SMILES

CCC(C(=O)OOC(=O)/C(=C(\C)/C(=O)OCC)/C)Cl

InChI

InChI=1S/C12H17ClO6/c1-5-9(13)12(16)19-18-11(15)8(4)7(3)10(14)17-6-2/h9H,5-6H2,1-4H3/b8-7+