dodecan-5-yl (E)-octadec-9-enoate

Systemtic Name: dodecan-5-yl (E)-octadec-9-enoate Openeye Name: 1-butyloctyl (E)-octadec-9-enoate CAS Name: (E)-9-octadecenoic acid dodecan-5-yl ester IUPAC Name: dodecan-5-yl (E)-octadec-9-enoate Traditional Name: (E)-octadec-9-enoic acid 1-butyloctyl ester Formula: C30H58O2 MolecularWeight: 450.78032

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCC(=O)OC(CCCC)CCCCCCC

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCC(=O)OC(CCCC)CCCCCCC

InChI

InChI=1S/C30H58O2/c1-4-7-10-12-13-14-15-16-17-18-19-20-21-23-25-28-30(31)32-29(26-9-6-3)27-24-22-11-8-5-2/h16-17,29H,4-15,18-28H2,1-3H3/b17-16+