hexadecyl 2-methylbutanoate

Systemtic Name: hexadecyl 2-methylbutanoate Openeye Name: hexadecyl 2-methylbutanoate CAS Name: 2-methylbutanoic acid hexadecyl ester IUPAC Name: hexadecyl 2-methylbutanoate Traditional Name: 2-methylbutyric acid cetyl ester Formula: C21H42O2 MolecularWeight: 326.55698

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC(=O)C(C)CC

Isomeric SMILES

CCCCCCCCCCCCCCCCOC(=O)C(C)CC

InChI

InChI=1S/C21H42O2/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18-19-23-21(22)20(3)5-2/h20H,4-19H2,1-3H3