1-(2-bromophenyl)ethyl docosanoate

Systemtic Name: 1-(2-bromophenyl)ethyl docosanoate Openeye Name: 1-(2-bromophenyl)ethyl docosanoate CAS Name: docosanoic acid 1-(2-bromophenyl)ethyl ester IUPAC Name: 1-(2-bromophenyl)ethyl docosanoate Traditional Name: behenic acid 1-(2-bromophenyl)ethyl ester Formula: C30H51BrO2 MolecularWeight: 523.62874

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCC(=O)OC(C)C1=CC=CC=C1Br

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCC(=O)OC(C)C1=CC=CC=C1Br

InChI

InChI=1S/C30H51BrO2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-26-30(32)33-27(2)28-24-22-23-25-29(28)31/h22-25,27H,3-21,26H2,1-2H3