octan-2-yl octadecanoate

Systemtic Name: octan-2-yl octadecanoate Openeye Name: 1-methylheptyl octadecanoate CAS Name: octadecanoic acid octan-2-yl ester IUPAC Name: octan-2-yl octadecanoate Traditional Name: stearic acid 1-methylheptyl ester Formula: C26H52O2 MolecularWeight: 396.68988

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)OC(C)CCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)OC(C)CCCCCC

InChI

InChI=1S/C26H52O2/c1-4-6-8-10-11-12-13-14-15-16-17-18-19-20-22-24-26(27)28-25(3)23-21-9-7-5-2/h25H,4-24H2,1-3H3