methyl 2-(2-ethanoylphenyl)docosanoate

Systemtic Name: methyl 2-(2-ethanoylphenyl)docosanoate Openeye Name: methyl 2-(2-acetylphenyl)docosanoate CAS Name: 2-(2-acetylphenyl)docosanoic acid methyl ester IUPAC Name: methyl 2-(2-acetylphenyl)docosanoate Traditional Name: 2-(2-acetylphenyl)behenic acid methyl ester Formula: C31H52O3 MolecularWeight: 472.74278

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCC(C1=CC=CC=C1C(=O)C)C(=O)OC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCC(C1=CC=CC=C1C(=O)C)C(=O)OC

InChI

InChI=1S/C31H52O3/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-26-30(31(33)34-3)29-25-23-22-24-28(29)27(2)32/h22-25,30H,4-21,26H2,1-3H3