O1-tert-butyl O3-(phenylmethyl) 2-[1-(3-oxidanylidenebutanoyloxy)ethyl]propanedioate

Systemtic Name: O1-tert-butyl O3-(phenylmethyl) 2-[1-(3-oxidanylidenebutanoyloxy)ethyl]propanedioate Openeye Name: O1-benzyl O3-tert-butyl 2-[1-(3-oxobutanoyloxy)ethyl]propanedioate CAS Name: 2-[1-(1,3-dioxobutoxy)ethyl]propanedioic acid O1-tert-butyl ester O3-(phenylmethyl) ester IUPAC Name: 3-O-benzyl 1-O-tert-butyl 2-[1-(3-oxobutanoyloxy)ethyl]propanedioate Traditional Name: 2-(1-acetoacetyloxyethyl)malonic acid O1-benzyl ester O3-tert-butyl ester Formula: C20H26O7 MolecularWeight: 378.41624

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C(=O)OCC1=CC=CC=C1)C(=O)OC(C)(C)C)OC(=O)CC(=O)C

Isomeric SMILES

CC(C(C(=O)OCC1=CC=CC=C1)C(=O)OC(C)(C)C)OC(=O)CC(=O)C

InChI

InChI=1S/C20H26O7/c1-13(21)11-16(22)26-14(2)17(19(24)27-20(3,4)5)18(23)25-12-15-9-7-6-8-10-15/h6-10,14,17H,11-12H2,1-5H3