(4E,6E,8E)-icosa-4,6,8-trien-2-ynoic acid

Systemtic Name: (4E,6E,8E)-icosa-4,6,8-trien-2-ynoic acid Openeye Name: (4E,6E,8E)-icosa-4,6,8-trien-2-ynoic acid CAS Name: (4E,6E,8E)-eicosa-4,6,8-trien-2-ynoic acid IUPAC Name: (4E,6E,8E)-icosa-4,6,8-trien-2-ynoic acid Traditional Name: (4E,6E,8E)-eicosa-4,6,8-trien-2-ynoic acid Formula: C20H30O2 MolecularWeight: 302.451

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC=CC=CC=CC#CC(=O)O

Isomeric SMILES

CCCCCCCCCCC/C=C/C=C/C=C/C#CC(=O)O

InChI

InChI=1S/C20H30O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h12-17H,2-11H2,1H3,(H,21,22)/b13-12+,15-14+,17-16+