bis(phenylmethyl) 2-[(1R)-3-oxidanylidene-1-phenyl-butyl]propanedioate

Systemtic Name: bis(phenylmethyl) 2-[(1R)-3-oxidanylidene-1-phenyl-butyl]propanedioate Openeye Name: dibenzyl 2-[(1R)-3-oxo-1-phenyl-butyl]propanedioate CAS Name: 2-[(1R)-3-oxo-1-phenylbutyl]propanedioic acid bis(phenylmethyl) ester IUPAC Name: dibenzyl 2-[(1R)-3-oxo-1-phenylbutyl]propanedioate Traditional Name: 2-[(1R)-3-keto-1-phenyl-butyl]malonic acid dibenzyl ester Formula: C27H26O5 MolecularWeight: 430.49234

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC(C1=CC=CC=C1)C(C(=O)OCC2=CC=CC=C2)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC(=O)C[C@@H](C1=CC=CC=C1)C(C(=O)OCC2=CC=CC=C2)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C27H26O5/c1-20(28)17-24(23-15-9-4-10-16-23)25(26(29)31-18-21-11-5-2-6-12-21)27(30)32-19-22-13-7-3-8-14-22/h2-16,24-25H,17-19H2,1H3/t24-/m0/s1