3,7-dimethyloct-6-enyl 2-(dioctylamino)ethanoate

Systemtic Name: 3,7-dimethyloct-6-enyl 2-(dioctylamino)ethanoate Openeye Name: 3,7-dimethyloct-6-enyl 2-(dioctylamino)acetate CAS Name: 2-(dioctylamino)acetic acid 3,7-dimethyloct-6-enyl ester IUPAC Name: 3,7-dimethyloct-6-enyl 2-(dioctylamino)acetate Traditional Name: 2-(dioctylamino)acetic acid 3,7-dimethyloct-6-enyl ester Formula: C28H55NO2 MolecularWeight: 437.7418

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN(CCCCCCCC)CC(=O)OCCC(C)CCC=C(C)C

Isomeric SMILES

CCCCCCCCN(CCCCCCCC)CC(=O)OCCC(C)CCC=C(C)C

InChI

InChI=1S/C28H55NO2/c1-6-8-10-12-14-16-22-29(23-17-15-13-11-9-7-2)25-28(30)31-24-21-27(5)20-18-19-26(3)4/h19,27H,6-18,20-25H2,1-5H3