(E)-14-oxidanylheptadec-12-en-10-ynoic acid

Systemtic Name: (E)-14-oxidanylheptadec-12-en-10-ynoic acid Openeye Name: (E)-14-hydroxyheptadec-12-en-10-ynoic acid CAS Name: (E)-14-hydroxyheptadec-12-en-10-ynoic acid IUPAC Name: (E)-14-hydroxyheptadec-12-en-10-ynoic acid Traditional Name: (E)-14-hydroxyheptadec-12-en-10-ynoic acid Formula: C17H28O3 MolecularWeight: 280.40242

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C=CC#CCCCCCCCCC(=O)O)O

Isomeric SMILES

CCCC(/C=C/C#CCCCCCCCCC(=O)O)O

InChI

InChI=1S/C17H28O3/c1-2-13-16(18)14-11-9-7-5-3-4-6-8-10-12-15-17(19)20/h11,14,16,18H,2-6,8,10,12-13,15H2,1H3,(H,19,20)/b14-11+