hexadecyl (3R)-3,7-dimethyloct-6-enoate

Systemtic Name: hexadecyl (3R)-3,7-dimethyloct-6-enoate Openeye Name: hexadecyl (3R)-3,7-dimethyloct-6-enoate CAS Name: (3R)-3,7-dimethyl-6-octenoic acid hexadecyl ester IUPAC Name: hexadecyl (3R)-3,7-dimethyloct-6-enoate Traditional Name: (3R)-3,7-dimethyloct-6-enoic acid cetyl ester Formula: C26H50O2 MolecularWeight: 394.674

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC(=O)CC(C)CCC=C(C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCOC(=O)C[C@H](C)CCC=C(C)C

InChI

InChI=1S/C26H50O2/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22-28-26(27)23-25(4)21-19-20-24(2)3/h20,25H,5-19,21-23H2,1-4H3/t25-/m1/s1