bis(phenylmethyl) 2,2-dihexadecylpropanedioate

Systemtic Name: bis(phenylmethyl) 2,2-dihexadecylpropanedioate Openeye Name: dibenzyl 2,2-dihexadecylpropanedioate CAS Name: 2,2-dihexadecylpropanedioic acid bis(phenylmethyl) ester IUPAC Name: dibenzyl 2,2-dihexadecylpropanedioate Traditional Name: 2,2-dicetylmalonic acid dibenzyl ester Formula: C49H80O4 MolecularWeight: 733.1571

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCC(CCCCCCCCCCCCCCCC)(C(=O)OCC1=CC=CC=C1)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

CCCCCCCCCCCCCCCCC(CCCCCCCCCCCCCCCC)(C(=O)OCC1=CC=CC=C1)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C49H80O4/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-35-41-49(47(50)52-43-45-37-31-29-32-38-45,48(51)53-44-46-39-33-30-34-40-46)42-36-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h29-34,37-40H,3-28,35-36,41-44H2,1-2H3