[2-oxidanylidene-2-(4-phenylphenyl)ethyl] docosanoate

Systemtic Name: [2-oxidanylidene-2-(4-phenylphenyl)ethyl] docosanoate Openeye Name: [2-oxo-2-(4-phenylphenyl)ethyl] docosanoate CAS Name: docosanoic acid [2-oxo-2-(4-phenylphenyl)ethyl] ester IUPAC Name: [2-oxo-2-(4-phenylphenyl)ethyl] docosanoate Traditional Name: behenic acid [2-keto-2-(4-phenylphenyl)ethyl] ester Formula: C36H54O3 MolecularWeight: 534.81216

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCC(=O)OCC(=O)C1=CC=C(C=C1)C2=CC=CC=C2

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCC(=O)OCC(=O)C1=CC=C(C=C1)C2=CC=CC=C2

InChI

InChI=1S/C36H54O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-23-26-36(38)39-31-35(37)34-29-27-33(28-30-34)32-24-21-20-22-25-32/h20-22,24-25,27-30H,2-19,23,26,31H2,1H3