2-methylpropyl 3-hexylundecanoate

Systemtic Name: 2-methylpropyl 3-hexylundecanoate Openeye Name: isobutyl 3-hexylundecanoate CAS Name: 3-hexylundecanoic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 3-hexylundecanoate Traditional Name: 3-hexylundecanoic acid isobutyl ester Formula: C21H42O2 MolecularWeight: 326.55698

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(CCCCCC)CC(=O)OCC(C)C

Isomeric SMILES

CCCCCCCCC(CCCCCC)CC(=O)OCC(C)C

InChI

InChI=1S/C21H42O2/c1-5-7-9-11-12-14-16-20(15-13-10-8-6-2)17-21(22)23-18-19(3)4/h19-20H,5-18H2,1-4H3