hexadecyl 2-bromanylbutanoate

Systemtic Name: hexadecyl 2-bromanylbutanoate Openeye Name: hexadecyl 2-bromobutanoate CAS Name: 2-bromobutanoic acid hexadecyl ester IUPAC Name: hexadecyl 2-bromobutanoate Traditional Name: 2-bromobutyric acid cetyl ester Formula: C20H39BrO2 MolecularWeight: 391.42646

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC(=O)C(CC)Br

Isomeric SMILES

CCCCCCCCCCCCCCCCOC(=O)C(CC)Br

InChI

InChI=1S/C20H39BrO2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-23-20(22)19(21)4-2/h19H,3-18H2,1-2H3