(E)-2-octyldocos-13-enoic acid

Systemtic Name: (E)-2-octyldocos-13-enoic acid Openeye Name: (E)-2-octyldocos-13-enoic acid CAS Name: (E)-2-octyl-13-docosenoic acid IUPAC Name: (E)-2-octyldocos-13-enoic acid Traditional Name: (E)-2-octyldocos-13-enoic acid Formula: C30H58O2 MolecularWeight: 450.78032

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCCCCC(CCCCCCCC)C(=O)O

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCCCCC(CCCCCCCC)C(=O)O

InChI

InChI=1S/C30H58O2/c1-3-5-7-9-11-12-13-14-15-16-17-18-19-20-21-22-24-26-28-29(30(31)32)27-25-23-10-8-6-4-2/h14-15,29H,3-13,16-28H2,1-2H3,(H,31,32)/b15-14+