O1-(2-methyl-4-oxidanylidene-4-phenylmethoxy-butan-2-yl) O3-(phenylmethyl) 2-(3-methylbutyl)propanedioate

Systemtic Name: O1-(2-methyl-4-oxidanylidene-4-phenylmethoxy-butan-2-yl) O3-(phenylmethyl) 2-(3-methylbutyl)propanedioate Openeye Name: O1-benzyl O3-(3-benzyloxy-1,1-dimethyl-3-oxo-propyl) 2-isopentylpropanedioate CAS Name: 2-(3-methylbutyl)propanedioic acid O1-(2-methyl-4-oxo-4-phenylmethoxybutan-2-yl) ester O3-(phenylmethyl) ester IUPAC Name: 3-O-benzyl 1-O-(2-methyl-4-oxo-4-phenylmethoxybutan-2-yl) 2-(3-methylbutyl)propanedioate Traditional Name: 2-isoamylmalonic acid O3-(3-benzoxy-3-keto-1,1-dimethyl-propyl) ester O1-benzyl ester Formula: C27H34O6 MolecularWeight: 454.55526

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(C(=O)OCC1=CC=CC=C1)C(=O)OC(C)(C)CC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)CCC(C(=O)OCC1=CC=CC=C1)C(=O)OC(C)(C)CC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C27H34O6/c1-20(2)15-16-23(25(29)32-19-22-13-9-6-10-14-22)26(30)33-27(3,4)17-24(28)31-18-21-11-7-5-8-12-21/h5-14,20,23H,15-19H2,1-4H3