propan-2-yl (4S)-4-methyldocosanoate

Systemtic Name: propan-2-yl (4S)-4-methyldocosanoate Openeye Name: isopropyl (4S)-4-methyldocosanoate CAS Name: (4S)-4-methyldocosanoic acid propan-2-yl ester IUPAC Name: propan-2-yl (4S)-4-methyldocosanoate Traditional Name: (4S)-4-methylbehenic acid isopropyl ester Formula: C26H52O2 MolecularWeight: 396.68988

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCC(C)CCC(=O)OC(C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCC[C@H](C)CCC(=O)OC(C)C

InChI

InChI=1S/C26H52O2/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-25(4)22-23-26(27)28-24(2)3/h24-25H,5-23H2,1-4H3/t25-/m0/s1