[4-[5,6-bis(3-oxidanylidenebutanoyloxy)hex-1-en-3-yloxy]-2-(3-oxidanylidenebutanoyloxy)hex-5-enyl] 3-oxidanylidenebutanoate

Systemtic Name: [4-[5,6-bis(3-oxidanylidenebutanoyloxy)hex-1-en-3-yloxy]-2-(3-oxidanylidenebutanoyloxy)hex-5-enyl] 3-oxidanylidenebutanoate Openeye Name: [4-[3,4-bis(3-oxobutanoyloxy)-1-vinyl-butoxy]-2-(3-oxobutanoyloxy)hex-5-enyl] 3-oxobutanoate CAS Name: 3-oxobutanoic acid [4-[5,6-bis(1,3-dioxobutoxy)hex-1-en-3-yloxy]-2-(1,3-dioxobutoxy)hex-5-enyl] ester IUPAC Name: [4-[5,6-bis(3-oxobutanoyloxy)hex-1-en-3-yloxy]-2-(3-oxobutanoyloxy)hex-5-enyl] 3-oxobutanoate Traditional Name: 3-ketobutyric acid [2-acetoacetyloxy-4-[1-(2,3-diacetoacetyloxypropyl)allyloxy]hex-5-enyl] ester Formula: C28H38O13 MolecularWeight: 582.59352

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC(=O)OCC(CC(C=C)OC(CC(COC(=O)CC(=O)C)OC(=O)CC(=O)C)C=C)OC(=O)CC(=O)C

Isomeric SMILES

CC(=O)CC(=O)OCC(CC(C=C)OC(CC(COC(=O)CC(=O)C)OC(=O)CC(=O)C)C=C)OC(=O)CC(=O)C

InChI

InChI=1S/C28H38O13/c1-7-21(13-23(40-27(35)11-19(5)31)15-37-25(33)9-17(3)29)39-22(8-2)14-24(41-28(36)12-20(6)32)16-38-26(34)10-18(4)30/h7-8,21-24H,1-2,9-16H2,3-6H3